N-(4-azanylcyclohexyl)-4-[2-methoxyethyl-(phenylmethyl)amino]-1-(4-methylphenyl)carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-4-[2-methoxyethyl-(phenylmethyl)amino]-1-(4-methylphenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-4-[benzyl(2-methoxyethyl)amino]-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-4-[2-methoxyethyl-(phenylmethyl)amino]-1-[(4-methylphenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-4-[benzyl(2-methoxyethyl)amino]-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-4-[benzyl(2-methoxyethyl)amino]-1-p-toluoyl-pyrrolidine-2-carboxamide Formula: C29H40N4O3 MolecularWeight: 492.6529

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)NC3CCC(CC3)N)N(CCOC)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)NC3CCC(CC3)N)N(CCOC)CC4=CC=CC=C4

InChI

InChI=1S/C29H40N4O3/c1-21-8-10-23(11-9-21)29(35)33-20-26(32(16-17-36-2)19-22-6-4-3-5-7-22)18-27(33)28(34)31-25-14-12-24(30)13-15-25/h3-11,24-27H,12-20,30H2,1-2H3,(H,31,34)