(E)-3-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]-2-(3-nitrophenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]-2-(3-nitrophenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-[2,5-dimethyl-1-(p-tolyl)pyrrol-3-yl]-2-(3-nitrobenzoyl)prop-2-enenitrile CAS Name: (E)-3-[2,5-dimethyl-1-(4-methylphenyl)-3-pyrrolyl]-2-[(3-nitrophenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]-2-(3-nitrobenzoyl)prop-2-enenitrile Traditional Name: (E)-3-[2,5-dimethyl-1-(p-tolyl)pyrrol-3-yl]-2-(3-nitrobenzoyl)acrylonitrile Formula: C23H19N3O3 MolecularWeight: 385.41526

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H19N3O3/c1-15-7-9-21(10-8-15)25-16(2)11-19(17(25)3)12-20(14-24)23(27)18-5-4-6-22(13-18)26(28)29/h4-13H,1-3H3/b20-12+