5-[[(E)-3-(4-ethylphenyl)prop-2-enoyl]amino]thiophene-2-carboxylic acid

Systemtic Name: 5-[[(E)-3-(4-ethylphenyl)prop-2-enoyl]amino]thiophene-2-carboxylic acid Openeye Name: 5-[[(E)-3-(4-ethylphenyl)prop-2-enoyl]amino]thiophene-2-carboxylic acid CAS Name: 5-[[(E)-3-(4-ethylphenyl)-1-oxoprop-2-enyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-[[(E)-3-(4-ethylphenyl)prop-2-enoyl]amino]thiophene-2-carboxylic acid Traditional Name: 5-[[(E)-3-(4-ethylphenyl)acryloyl]amino]-2-thenoic acid Formula: C16H15NO3S MolecularWeight: 301.3602

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C=CC(=O)NC2=CC=C(S2)C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)/C=C/C(=O)NC2=CC=C(S2)C(=O)O

InChI

InChI=1S/C16H15NO3S/c1-2-11-3-5-12(6-4-11)7-9-14(18)17-15-10-8-13(21-15)16(19)20/h3-10H,2H2,1H3,(H,17,18)(H,19,20)/b9-7+