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

Systemtic Name: N-[(E)-[1-(4-bromophenyl)-2,5-diphenyl-pyrrol-3-yl]methylideneamino]-3-nitro-aniline Openeye Name: N-[(E)-[1-(4-bromophenyl)-2,5-diphenyl-pyrrol-3-yl]methyleneamino]-3-nitro-aniline CAS Name: N-[(E)-[1-(4-bromophenyl)-2,5-diphenyl-3-pyrrolyl]methylideneamino]-3-nitroaniline IUPAC Name: N-[(E)-[1-(4-bromophenyl)-2,5-diphenylpyrrol-3-yl]methylideneamino]-3-nitroaniline Traditional Name: [(E)-[1-(4-bromophenyl)-2,5-diphenyl-pyrrol-3-yl]methyleneamino]-(3-nitrophenyl)amine Formula: C29H21BrN4O2 MolecularWeight: 537.40664

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C(N2C3=CC=C(C=C3)Br)C4=CC=CC=C4)C=NNC5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C(N2C3=CC=C(C=C3)Br)C4=CC=CC=C4)/C=N/NC5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C29H21BrN4O2/c30-24-14-16-26(17-15-24)33-28(21-8-3-1-4-9-21)18-23(29(33)22-10-5-2-6-11-22)20-31-32-25-12-7-13-27(19-25)34(35)36/h1-20,32H/b31-20+