N-[(E)-[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-4-nitro-benzamide

Systemtic Name: N-[(E)-[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-4-nitro-benzamide Openeye Name: N-[(E)-[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-4-nitro-benzamide CAS Name: N-[(E)-[1-(2,6-dimethylphenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-4-nitrobenzamide IUPAC Name: N-[(E)-[1-(2,6-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-4-nitrobenzamide Traditional Name: N-[(E)-[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-4-nitro-benzamide Formula: C22H22N4O3 MolecularWeight: 390.43508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=CC(=C2C)C=NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=CC(=C2C)/C=N/NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C22H22N4O3/c1-14-6-5-7-15(2)21(14)25-16(3)12-19(17(25)4)13-23-24-22(27)18-8-10-20(11-9-18)26(28)29/h5-13H,1-4H3,(H,24,27)/b23-13+