[1-(3-methoxyphenyl)carbonyl-4-[(3-methoxyphenyl)methyl-[(4-nitrophenyl)methyl]amino]pyrrolidin-2-yl]-piperazin-1-yl-methanone

Systemtic Name: [1-(3-methoxyphenyl)carbonyl-4-[(3-methoxyphenyl)methyl-[(4-nitrophenyl)methyl]amino]pyrrolidin-2-yl]-piperazin-1-yl-methanone Openeye Name: [1-(3-methoxybenzoyl)-4-[(3-methoxyphenyl)methyl-[(4-nitrophenyl)methyl]amino]pyrrolidin-2-yl]-piperazin-1-yl-methanone CAS Name: [4-[(3-methoxyphenyl)methyl-[(4-nitrophenyl)methyl]amino]-1-[(3-methoxyphenyl)-oxomethyl]-2-pyrrolidinyl]-(1-piperazinyl)methanone IUPAC Name: [1-(3-methoxybenzoyl)-4-[(3-methoxyphenyl)methyl-[(4-nitrophenyl)methyl]amino]pyrrolidin-2-yl]-piperazin-1-ylmethanone Traditional Name: [1-m-anisoyl-4-[m-anisyl-(4-nitrobenzyl)amino]pyrrolidin-2-yl]-piperazino-methanone Formula: C32H37N5O6 MolecularWeight: 587.66608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN(CC2=CC=C(C=C2)[N+](=O)[O-])C3CC(N(C3)C(=O)C4=CC(=CC=C4)OC)C(=O)N5CCNCC5

Isomeric SMILES

COC1=CC=CC(=C1)CN(CC2=CC=C(C=C2)[N+](=O)[O-])C3CC(N(C3)C(=O)C4=CC(=CC=C4)OC)C(=O)N5CCNCC5

InChI

InChI=1S/C32H37N5O6/c1-42-28-7-3-5-24(17-28)21-35(20-23-9-11-26(12-10-23)37(40)41)27-19-30(32(39)34-15-13-33-14-16-34)36(22-27)31(38)25-6-4-8-29(18-25)43-2/h3-12,17-18,27,30,33H,13-16,19-22H2,1-2H3