(E)-2-cyano-3-[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]-N-(3-methoxyphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]-N-(3-methoxyphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]-N-(3-methoxyphenyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[1-(2,6-dimethylphenyl)-2,5-dimethyl-3-pyrrolyl]-N-(3-methoxyphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-[1-(2,6-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]-N-(3-methoxyphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]-N-(3-methoxyphenyl)acrylamide Formula: C25H25N3O2 MolecularWeight: 399.4849

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=CC(=C2C)C=C(C#N)C(=O)NC3=CC(=CC=C3)OC)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=CC(=C2C)/C=C(\C#N)/C(=O)NC3=CC(=CC=C3)OC)C

InChI

InChI=1S/C25H25N3O2/c1-16-8-6-9-17(2)24(16)28-18(3)12-20(19(28)4)13-21(15-26)25(29)27-22-10-7-11-23(14-22)30-5/h6-14H,1-5H3,(H,27,29)/b21-13+