[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 4-oxidanylidene-4-thiophen-2-yl-butanoate

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 4-oxidanylidene-4-thiophen-2-yl-butanoate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] 4-oxo-4-(2-thienyl)butanoate CAS Name: 4-oxo-4-thiophen-2-ylbutanoic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] 4-oxo-4-thiophen-2-ylbutanoate Traditional Name: 4-keto-4-(2-thienyl)butyric acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C14H14N2O4S MolecularWeight: 306.33696

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)COC(=O)CCC(=O)C1=CC=CS1)N

Isomeric SMILES

C/C(=C(/C#N)\C(=O)COC(=O)CCC(=O)C1=CC=CS1)/N

InChI

InChI=1S/C14H14N2O4S/c1-9(16)10(7-15)12(18)8-20-14(19)5-4-11(17)13-3-2-6-21-13/h2-3,6H,4-5,8,16H2,1H3/b10-9+