(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) (E)-3-thiophen-3-ylprop-2-enoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) (E)-3-thiophen-3-ylprop-2-enoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) (E)-3-(3-thienyl)prop-2-enoate CAS Name: (E)-3-(3-thiophenyl)-2-propenoic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) (E)-3-thiophen-3-ylprop-2-enoate Traditional Name: (E)-3-(3-thienyl)acrylic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C13H12N2O3S MolecularWeight: 276.31098

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)C=CC1=CSC=C1

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)/C=C/C1=CSC=C1

InChI

InChI=1S/C13H12N2O3S/c1-9(15)11(6-14)12(16)7-18-13(17)3-2-10-4-5-19-8-10/h2-5,8,11,15H,7H2,1H3/b3-2+,15-9?