2-[[(E)-2-cyano-3-thiophen-2-yl-prop-2-enoyl]amino]benzoate

Systemtic Name: 2-[[(E)-2-cyano-3-thiophen-2-yl-prop-2-enoyl]amino]benzoate Openeye Name: 2-[[(E)-2-cyano-3-(2-thienyl)prop-2-enoyl]amino]benzoate CAS Name: 2-[[(E)-2-cyano-1-oxo-3-thiophen-2-ylprop-2-enyl]amino]benzoate IUPAC Name: 2-[[(E)-2-cyano-3-thiophen-2-ylprop-2-enoyl]amino]benzoate Traditional Name: 2-[[(E)-2-cyano-3-(2-thienyl)acryloyl]amino]benzoate Formula: C15H9N2O3S- MolecularWeight: 297.30856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)[O-])NC(=O)C(=CC2=CC=CS2)C#N

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)[O-])NC(=O)/C(=C/C2=CC=CS2)/C#N

InChI

InChI=1S/C15H10N2O3S/c16-9-10(8-11-4-3-7-21-11)14(18)17-13-6-2-1-5-12(13)15(19)20/h1-8H,(H,17,18)(H,19,20)/p-1/b10-8+