N-(4-azanylcyclohexyl)-1-cyclopropylcarbonyl-4-[2-methylpropyl-[(4-nitrophenyl)methyl]amino]pyrrolidine-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-1-cyclopropylcarbonyl-4-[2-methylpropyl-[(4-nitrophenyl)methyl]amino]pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-1-(cyclopropanecarbonyl)-4-[isobutyl-[(4-nitrophenyl)methyl]amino]pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-1-[cyclopropyl(oxo)methyl]-4-[2-methylpropyl-[(4-nitrophenyl)methyl]amino]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-1-(cyclopropanecarbonyl)-4-[2-methylpropyl-[(4-nitrophenyl)methyl]amino]pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-1-(cyclopropanecarbonyl)-4-[isobutyl-(4-nitrobenzyl)amino]pyrrolidine-2-carboxamide Formula: C26H39N5O4 MolecularWeight: 485.61896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC=C(C=C1)[N+](=O)[O-])C2CC(N(C2)C(=O)C3CC3)C(=O)NC4CCC(CC4)N

Isomeric SMILES

CC(C)CN(CC1=CC=C(C=C1)[N+](=O)[O-])C2CC(N(C2)C(=O)C3CC3)C(=O)NC4CCC(CC4)N

InChI

InChI=1S/C26H39N5O4/c1-17(2)14-29(15-18-3-11-22(12-4-18)31(34)35)23-13-24(30(16-23)26(33)19-5-6-19)25(32)28-21-9-7-20(27)8-10-21/h3-4,11-12,17,19-21,23-24H,5-10,13-16,27H2,1-2H3,(H,28,32)