3-methyl-4-[[(E)-3-(3-methylthiophen-2-yl)prop-2-enoyl]amino]benzoic acid

Systemtic Name: 3-methyl-4-[[(E)-3-(3-methylthiophen-2-yl)prop-2-enoyl]amino]benzoic acid Openeye Name: 3-methyl-4-[[(E)-3-(3-methyl-2-thienyl)prop-2-enoyl]amino]benzoic acid CAS Name: 3-methyl-4-[[(E)-3-(3-methyl-2-thiophenyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 3-methyl-4-[[(E)-3-(3-methylthiophen-2-yl)prop-2-enoyl]amino]benzoic acid Traditional Name: 3-methyl-4-[[(E)-3-(3-methyl-2-thienyl)acryloyl]amino]benzoic acid Formula: C16H15NO3S MolecularWeight: 301.3602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C=CC(=O)NC2=C(C=C(C=C2)C(=O)O)C

Isomeric SMILES

CC1=C(SC=C1)/C=C/C(=O)NC2=C(C=C(C=C2)C(=O)O)C

InChI

InChI=1S/C16H15NO3S/c1-10-7-8-21-14(10)5-6-15(18)17-13-4-3-12(16(19)20)9-11(13)2/h3-9H,1-2H3,(H,17,18)(H,19,20)/b6-5+