N-(4-azanylcyclohexyl)-4-[3,3-dimethylbutanoyl(phenethyl)amino]-1-(3-methoxyphenyl)carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-4-[3,3-dimethylbutanoyl(phenethyl)amino]-1-(3-methoxyphenyl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-4-[3,3-dimethylbutanoyl(phenethyl)amino]-1-(3-methoxybenzoyl)pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-4-[(3,3-dimethyl-1-oxobutyl)-phenethylamino]-1-[(3-methoxyphenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-4-[3,3-dimethylbutanoyl(phenethyl)amino]-1-(3-methoxybenzoyl)pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-4-[3,3-dimethylbutanoyl(phenethyl)amino]-1-m-anisoyl-pyrrolidine-2-carboxamide Formula: C33H46N4O4 MolecularWeight: 562.74274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N(CCC1=CC=CC=C1)C2CC(N(C2)C(=O)C3=CC(=CC=C3)OC)C(=O)NC4CCC(CC4)N

Isomeric SMILES

CC(C)(C)CC(=O)N(CCC1=CC=CC=C1)C2CC(N(C2)C(=O)C3=CC(=CC=C3)OC)C(=O)NC4CCC(CC4)N

InChI

InChI=1S/C33H46N4O4/c1-33(2,3)21-30(38)36(18-17-23-9-6-5-7-10-23)27-20-29(31(39)35-26-15-13-25(34)14-16-26)37(22-27)32(40)24-11-8-12-28(19-24)41-4/h5-12,19,25-27,29H,13-18,20-22,34H2,1-4H3,(H,35,39)