[4-[[4-(hydroxymethyl)phenyl]methyl-(4-nitrophenyl)amino]-1-methyl-pyrrol-2-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-[[4-(hydroxymethyl)phenyl]methyl-(4-nitrophenyl)amino]-1-methyl-pyrrol-2-yl]-pyrrolidin-1-yl-methanone Openeye Name: [4-[N-[[4-(hydroxymethyl)phenyl]methyl]-4-nitro-anilino]-1-methyl-pyrrol-2-yl]-pyrrolidin-1-yl-methanone CAS Name: [4-[N-[[4-(hydroxymethyl)phenyl]methyl]-4-nitroanilino]-1-methyl-2-pyrrolyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-[N-[[4-(hydroxymethyl)phenyl]methyl]-4-nitroanilino]-1-methylpyrrol-2-yl]-pyrrolidin-1-ylmethanone Traditional Name: [1-methyl-4-(N-(4-methylolbenzyl)-4-nitro-anilino)pyrrol-2-yl]-pyrrolidino-methanone Formula: C24H26N4O4 MolecularWeight: 434.48764

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N2CCCC2)N(CC3=CC=C(C=C3)CO)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)N2CCCC2)N(CC3=CC=C(C=C3)CO)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H26N4O4/c1-25-16-22(14-23(25)24(30)26-12-2-3-13-26)27(15-18-4-6-19(17-29)7-5-18)20-8-10-21(11-9-20)28(31)32/h4-11,14,16,29H,2-3,12-13,15,17H2,1H3