ethyl 2-[(4-chlorophenyl)methyl]azepane-1-carboxylate

Systemtic Name: ethyl 2-[(4-chlorophenyl)methyl]azepane-1-carboxylate Openeye Name: ethyl 2-[(4-chlorophenyl)methyl]azepane-1-carboxylate CAS Name: 2-[(4-chlorophenyl)methyl]-1-azepanecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-chlorophenyl)methyl]azepane-1-carboxylate Traditional Name: 2-(4-chlorobenzyl)azepane-1-carboxylic acid ethyl ester Formula: C16H22ClNO2 MolecularWeight: 295.80438

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCCCCC1CC2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)N1CCCCCC1CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H22ClNO2/c1-2-20-16(19)18-11-5-3-4-6-15(18)12-13-7-9-14(17)10-8-13/h7-10,15H,2-6,11-12H2,1H3