1-[(3-chlorophenyl)methyl]-5-[(3,4-dimethoxyphenyl)methyl-methyl-amino]azepan-2-one

Systemtic Name: 1-[(3-chlorophenyl)methyl]-5-[(3,4-dimethoxyphenyl)methyl-methyl-amino]azepan-2-one Openeye Name: 1-[(3-chlorophenyl)methyl]-5-[(3,4-dimethoxyphenyl)methyl-methyl-amino]azepan-2-one CAS Name: 1-[(3-chlorophenyl)methyl]-5-[(3,4-dimethoxyphenyl)methyl-methylamino]-2-azepanone IUPAC Name: 1-[(3-chlorophenyl)methyl]-5-[(3,4-dimethoxyphenyl)methyl-methylamino]azepan-2-one Traditional Name: 1-(3-chlorobenzyl)-5-[methyl(veratryl)amino]azepan-2-one Formula: C23H29ClN2O3 MolecularWeight: 416.94096

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OC)OC)C2CCC(=O)N(CC2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OC)OC)C2CCC(=O)N(CC2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C23H29ClN2O3/c1-25(15-18-7-9-21(28-2)22(14-18)29-3)20-8-10-23(27)26(12-11-20)16-17-5-4-6-19(24)13-17/h4-7,9,13-14,20H,8,10-12,15-16H2,1-3H3