(Z)-3-(1-butyl-2,5-dimethyl-pyrrol-3-yl)-2-cyano-prop-2-enoate

Systemtic Name: (Z)-3-(1-butyl-2,5-dimethyl-pyrrol-3-yl)-2-cyano-prop-2-enoate Openeye Name: (Z)-3-(1-butyl-2,5-dimethyl-pyrrol-3-yl)-2-cyano-prop-2-enoate CAS Name: (Z)-3-(1-butyl-2,5-dimethyl-3-pyrrolyl)-2-cyano-2-propenoate IUPAC Name: (Z)-3-(1-butyl-2,5-dimethylpyrrol-3-yl)-2-cyanoprop-2-enoate Traditional Name: (Z)-3-(1-butyl-2,5-dimethyl-pyrrol-3-yl)-2-cyano-acrylate Formula: C14H17N2O2- MolecularWeight: 245.29698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CC(=C1C)C=C(C#N)C(=O)[O-])C

Isomeric SMILES

CCCCN1C(=CC(=C1C)/C=C(/C#N)\C(=O)[O-])C

InChI

InChI=1S/C14H18N2O2/c1-4-5-6-16-10(2)7-12(11(16)3)8-13(9-15)14(17)18/h7-8H,4-6H2,1-3H3,(H,17,18)/p-1/b13-8-