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

Systemtic Name: N-[(E)-[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-2-nitro-4-(trifluoromethyl)aniline Openeye Name: N-[(E)-[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-2-nitro-4-(trifluoromethyl)aniline CAS Name: N-[(E)-[1-(4-iodophenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-2-nitro-4-(trifluoromethyl)aniline IUPAC Name: N-[(E)-[1-(4-iodophenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-2-nitro-4-(trifluoromethyl)aniline Traditional Name: [(E)-[1-(4-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-[2-nitro-4-(trifluoromethyl)phenyl]amine Formula: C20H16F3IN4O2 MolecularWeight: 528.26632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16F3IN4O2/c1-12-9-14(13(2)27(12)17-6-4-16(24)5-7-17)11-25-26-18-8-3-15(20(21,22)23)10-19(18)28(29)30/h3-11,26H,1-2H3/b25-11+