[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 4-chloro-2-nitrobenzoate
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![[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 4-chloro-2-nitrobenzoate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/d236491093da45da9981b958366e1c2f.png "[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 4-chloro-2-nitrobenzoate")
[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 4-chloro-2-nitrobenzoate
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CAS No:
389586-77-0
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Formula:
C18H15ClN2O5
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Chemical Name:
[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 4-chloro-2-nitrobenzoate
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Synonyms:
ZINC3271335;AKOS033707090;MCULE-3970871112;Z19773692;2-oxo-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethyl 4-chloro-2-nitrobenzoate;389586-77-0
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CAS No:
[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 4-chloro-2-nitrobenzoate Basic Attributes
374.8 g/mol
374.0669493 g/mol
Computed Properties
Molecular Weight:374.8
XLogP3:3.3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:374.0669493
Monoisotopic Mass:374.0669493
Topological Polar Surface Area:92.4
Heavy Atom Count:26
Complexity:552
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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