N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-[(phenylmethyl)carbamoylamino]cyclopentane-1-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-[(phenylmethyl)carbamoylamino]cyclopentane-1-carboxamide Openeye Name: 1-(benzylcarbamoylamino)-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-cyclopentanecarboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-1-[[oxo-[(phenylmethyl)amino]methyl]amino]-1-cyclopentanecarboxamide IUPAC Name: 1-(benzylcarbamoylamino)-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylcyclopentane-1-carboxamide Traditional Name: 1-(benzylcarbamoylamino)-N-homoveratryl-N-methyl-cyclopentanecarboxamide Formula: C25H33N3O4 MolecularWeight: 439.54722

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)C(=O)C2(CCCC2)NC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)C(=O)C2(CCCC2)NC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C25H33N3O4/c1-28(16-13-19-11-12-21(31-2)22(17-19)32-3)23(29)25(14-7-8-15-25)27-24(30)26-18-20-9-5-4-6-10-20/h4-6,9-12,17H,7-8,13-16,18H2,1-3H3,(H2,26,27,30)