(E)-2-cyano-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-N-(4-methyl-3-nitro-phenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-N-(4-methyl-3-nitro-phenyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-N-(4-methyl-3-nitro-phenyl)prop-2-enamide CAS Name: (E)-2-cyano-3-(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-N-(4-methyl-3-nitrophenyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-N-(4-methyl-3-nitrophenyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-N-(4-methyl-3-nitro-phenyl)acrylamide Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(=CC2=C(N(C(=C2)C)C3CC3)C)C#N)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)/C(=C/C2=C(N(C(=C2)C)C3CC3)C)/C#N)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O3/c1-12-4-5-17(10-19(12)24(26)27)22-20(25)16(11-21)9-15-8-13(2)23(14(15)3)18-6-7-18/h4-5,8-10,18H,6-7H2,1-3H3,(H,22,25)/b16-9+