N-[(E)-[1-(4-iodanyl-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-2,4-dinitro-aniline

Systemtic Name: N-[(E)-[1-(4-iodanyl-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-2,4-dinitro-aniline Openeye Name: N-[(E)-[1-(4-iodo-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-2,4-dinitro-aniline CAS Name: N-[(E)-[1-(4-iodo-3-methylphenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-2,4-dinitroaniline IUPAC Name: N-[(E)-[1-(4-iodo-3-methylphenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-[(E)-[1-(4-iodo-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]amine Formula: C20H18IN5O4 MolecularWeight: 519.29249

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18IN5O4/c1-12-8-16(4-6-18(12)21)24-13(2)9-15(14(24)3)11-22-23-19-7-5-17(25(27)28)10-20(19)26(29)30/h4-11,23H,1-3H3/b22-11+