4-methyl-3-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzoic acid

Systemtic Name: 4-methyl-3-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzoic acid Openeye Name: 4-methyl-3-[[(E)-3-(2-thienyl)prop-2-enoyl]amino]benzoic acid CAS Name: 4-methyl-3-[[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]amino]benzoic acid IUPAC Name: 4-methyl-3-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzoic acid Traditional Name: 4-methyl-3-[[(E)-3-(2-thienyl)acryloyl]amino]benzoic acid Formula: C15H13NO3S MolecularWeight: 287.33362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NC(=O)C=CC2=CC=CS2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NC(=O)/C=C/C2=CC=CS2

InChI

InChI=1S/C15H13NO3S/c1-10-4-5-11(15(18)19)9-13(10)16-14(17)7-6-12-3-2-8-20-12/h2-9H,1H3,(H,16,17)(H,18,19)/b7-6+