4-[[[(E)-3-(5-methylthiophen-2-yl)prop-2-enoyl]amino]methyl]benzoic acid

Systemtic Name: 4-[[[(E)-3-(5-methylthiophen-2-yl)prop-2-enoyl]amino]methyl]benzoic acid Openeye Name: 4-[[[(E)-3-(5-methyl-2-thienyl)prop-2-enoyl]amino]methyl]benzoic acid CAS Name: 4-[[[(E)-3-(5-methyl-2-thiophenyl)-1-oxoprop-2-enyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[(E)-3-(5-methylthiophen-2-yl)prop-2-enoyl]amino]methyl]benzoic acid Traditional Name: 4-[[[(E)-3-(5-methyl-2-thienyl)acryloyl]amino]methyl]benzoic acid Formula: C16H15NO3S MolecularWeight: 301.3602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C=CC(=O)NCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC1=CC=C(S1)/C=C/C(=O)NCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C16H15NO3S/c1-11-2-7-14(21-11)8-9-15(18)17-10-12-3-5-13(6-4-12)16(19)20/h2-9H,10H2,1H3,(H,17,18)(H,19,20)/b9-8+