4-[(E)-2-cyano-3-oxidanylidene-3-pyrrolidin-1-yl-prop-1-enyl]benzoate

Systemtic Name: 4-[(E)-2-cyano-3-oxidanylidene-3-pyrrolidin-1-yl-prop-1-enyl]benzoate Openeye Name: 4-[(E)-2-cyano-3-oxo-3-pyrrolidin-1-yl-prop-1-enyl]benzoate CAS Name: 4-[(E)-2-cyano-3-oxo-3-(1-pyrrolidinyl)prop-1-enyl]benzoate IUPAC Name: 4-[(E)-2-cyano-3-oxo-3-pyrrolidin-1-ylprop-1-enyl]benzoate Traditional Name: 4-[(E)-2-cyano-3-keto-3-pyrrolidino-prop-1-enyl]benzoate Formula: C15H13N2O3- MolecularWeight: 269.27532

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C(=CC2=CC=C(C=C2)C(=O)[O-])C#N

Isomeric SMILES

C1CCN(C1)C(=O)/C(=C/C2=CC=C(C=C2)C(=O)[O-])/C#N

InChI

InChI=1S/C15H14N2O3/c16-10-13(14(18)17-7-1-2-8-17)9-11-3-5-12(6-4-11)15(19)20/h3-6,9H,1-2,7-8H2,(H,19,20)/p-1/b13-9+