ethyl (E)-2-cyano-3-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)prop-2-enoate Openeye Name: ethyl (E)-3-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-cyano-prop-2-enoate CAS Name: (E)-3-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-cyano-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-cyanoprop-2-enoate Traditional Name: (E)-3-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-cyano-acrylic acid ethyl ester Formula: C14H16N2O3 MolecularWeight: 260.28844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=C(C(=C(N1)C)C(=O)C)C)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=C(C(=C(N1)C)C(=O)C)C)/C#N

InChI

InChI=1S/C14H16N2O3/c1-5-19-14(18)11(7-15)6-12-8(2)13(10(4)17)9(3)16-12/h6,16H,5H2,1-4H3/b11-6+