2-[[(E)-2-benzamido-3-thiophen-2-yl-prop-2-enoyl]amino]ethanoate

Systemtic Name: 2-[[(E)-2-benzamido-3-thiophen-2-yl-prop-2-enoyl]amino]ethanoate Openeye Name: 2-[[(E)-2-benzamido-3-(2-thienyl)prop-2-enoyl]amino]acetate CAS Name: 2-[[(E)-2-benzamido-1-oxo-3-thiophen-2-ylprop-2-enyl]amino]acetate IUPAC Name: 2-[[(E)-2-benzamido-3-thiophen-2-ylprop-2-enoyl]amino]acetate Traditional Name: 2-[[(E)-2-benzamido-3-(2-thienyl)acryloyl]amino]acetate Formula: C16H13N2O4S- MolecularWeight: 329.35042

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N2O4S/c19-14(20)10-17-16(22)13(9-12-7-4-8-23-12)18-15(21)11-5-2-1-3-6-11/h1-9H,10H2,(H,17,22)(H,18,21)(H,19,20)/p-1/b13-9+