N-(2-azanylethyl)-1-(4-methylphenyl)carbonyl-4-[2-methylpropyl-[(4-nitrophenyl)methyl]amino]pyrrolidine-2-carboxamide

Systemtic Name: N-(2-azanylethyl)-1-(4-methylphenyl)carbonyl-4-[2-methylpropyl-[(4-nitrophenyl)methyl]amino]pyrrolidine-2-carboxamide Openeye Name: N-(2-aminoethyl)-4-[isobutyl-[(4-nitrophenyl)methyl]amino]-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide CAS Name: N-(2-aminoethyl)-1-[(4-methylphenyl)-oxomethyl]-4-[2-methylpropyl-[(4-nitrophenyl)methyl]amino]-2-pyrrolidinecarboxamide IUPAC Name: N-(2-aminoethyl)-1-(4-methylbenzoyl)-4-[2-methylpropyl-[(4-nitrophenyl)methyl]amino]pyrrolidine-2-carboxamide Traditional Name: N-(2-aminoethyl)-4-[isobutyl-(4-nitrobenzyl)amino]-1-p-toluoyl-pyrrolidine-2-carboxamide Formula: C26H35N5O4 MolecularWeight: 481.5872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)NCCN)N(CC3=CC=C(C=C3)[N+](=O)[O-])CC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CC(CC2C(=O)NCCN)N(CC3=CC=C(C=C3)[N+](=O)[O-])CC(C)C

InChI

InChI=1S/C26H35N5O4/c1-18(2)15-29(16-20-6-10-22(11-7-20)31(34)35)23-14-24(25(32)28-13-12-27)30(17-23)26(33)21-8-4-19(3)5-9-21/h4-11,18,23-24H,12-17,27H2,1-3H3,(H,28,32)