N-[(E)-[1-(4-methylphenyl)-2,5-diphenyl-pyrrol-3-yl]methylideneamino]-4-nitro-benzamide

Systemtic Name: N-[(E)-[1-(4-methylphenyl)-2,5-diphenyl-pyrrol-3-yl]methylideneamino]-4-nitro-benzamide Openeye Name: N-[(E)-[2,5-diphenyl-1-(p-tolyl)pyrrol-3-yl]methyleneamino]-4-nitro-benzamide CAS Name: N-[(E)-[1-(4-methylphenyl)-2,5-diphenyl-3-pyrrolyl]methylideneamino]-4-nitrobenzamide IUPAC Name: N-[(E)-[1-(4-methylphenyl)-2,5-diphenylpyrrol-3-yl]methylideneamino]-4-nitrobenzamide Traditional Name: N-[(E)-[2,5-diphenyl-1-(p-tolyl)pyrrol-3-yl]methyleneamino]-4-nitro-benzamide Formula: C31H24N4O3 MolecularWeight: 500.54726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=C2C3=CC=CC=C3)C=NNC(=O)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=C2C3=CC=CC=C3)/C=N/NC(=O)C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C31H24N4O3/c1-22-12-16-27(17-13-22)34-29(23-8-4-2-5-9-23)20-26(30(34)24-10-6-3-7-11-24)21-32-33-31(36)25-14-18-28(19-15-25)35(37)38/h2-21H,1H3,(H,33,36)/b32-21+