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

Systemtic Name: N-[(E)-[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-3-nitro-aniline Openeye Name: N-[(E)-[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-3-nitro-aniline CAS Name: N-[(E)-[1-(4-iodophenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-3-nitroaniline IUPAC Name: N-[(E)-[1-(4-iodophenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-3-nitroaniline Traditional Name: [(E)-[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-(3-nitrophenyl)amine Formula: C19H17IN4O2 MolecularWeight: 460.26835

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)I)C)C=NNC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)I)C)/C=N/NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H17IN4O2/c1-13-10-15(14(2)23(13)18-8-6-16(20)7-9-18)12-21-22-17-4-3-5-19(11-17)24(25)26/h3-12,22H,1-2H3/b21-12+