(E)-3-(1-butyl-2,5-dimethyl-pyrrol-3-yl)-2-cyano-N-(2-methoxy-5-methyl-phenyl)prop-2-enamide

Systemtic Name: (E)-3-(1-butyl-2,5-dimethyl-pyrrol-3-yl)-2-cyano-N-(2-methoxy-5-methyl-phenyl)prop-2-enamide Openeye Name: (E)-3-(1-butyl-2,5-dimethyl-pyrrol-3-yl)-2-cyano-N-(2-methoxy-5-methyl-phenyl)prop-2-enamide CAS Name: (E)-3-(1-butyl-2,5-dimethyl-3-pyrrolyl)-2-cyano-N-(2-methoxy-5-methylphenyl)-2-propenamide IUPAC Name: (E)-3-(1-butyl-2,5-dimethylpyrrol-3-yl)-2-cyano-N-(2-methoxy-5-methylphenyl)prop-2-enamide Traditional Name: (E)-3-(1-butyl-2,5-dimethyl-pyrrol-3-yl)-2-cyano-N-(2-methoxy-5-methyl-phenyl)acrylamide Formula: C22H27N3O2 MolecularWeight: 365.46868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CC(=C1C)C=C(C#N)C(=O)NC2=C(C=CC(=C2)C)OC)C

Isomeric SMILES

CCCCN1C(=CC(=C1C)/C=C(\C#N)/C(=O)NC2=C(C=CC(=C2)C)OC)C

InChI

InChI=1S/C22H27N3O2/c1-6-7-10-25-16(3)12-18(17(25)4)13-19(14-23)22(26)24-20-11-15(2)8-9-21(20)27-5/h8-9,11-13H,6-7,10H2,1-5H3,(H,24,26)/b19-13+