[3-[(3-ethyl-1-methyl-2-oxidanylidene-azepan-3-yl)methyl]phenyl] N-(4-chlorophenyl)carbamate

Systemtic Name: [3-[(3-ethyl-1-methyl-2-oxidanylidene-azepan-3-yl)methyl]phenyl] N-(4-chlorophenyl)carbamate Openeye Name: [3-[(3-ethyl-1-methyl-2-oxo-azepan-3-yl)methyl]phenyl] N-(4-chlorophenyl)carbamate CAS Name: N-(4-chlorophenyl)carbamic acid [3-[(3-ethyl-1-methyl-2-oxo-3-azepanyl)methyl]phenyl] ester IUPAC Name: [3-[(3-ethyl-1-methyl-2-oxoazepan-3-yl)methyl]phenyl] N-(4-chlorophenyl)carbamate Traditional Name: N-(4-chlorophenyl)carbamic acid [3-[(3-ethyl-2-keto-1-methyl-azepan-3-yl)methyl]phenyl] ester Formula: C23H27ClN2O3 MolecularWeight: 414.92508

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCCCN(C1=O)C)CC2=CC(=CC=C2)OC(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CCC1(CCCCN(C1=O)C)CC2=CC(=CC=C2)OC(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H27ClN2O3/c1-3-23(13-4-5-14-26(2)21(23)27)16-17-7-6-8-20(15-17)29-22(28)25-19-11-9-18(24)10-12-19/h6-12,15H,3-5,13-14,16H2,1-2H3,(H,25,28)