2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-3-sulfanyl-propanoic acid

Systemtic Name: 2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-3-sulfanyl-propanoic acid Openeye Name: 2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-3-sulfanyl-propanoic acid CAS Name: 3-mercapto-2-[[(E)-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]amino]propanoic acid IUPAC Name: 2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-3-sulfanylpropanoic acid Traditional Name: 3-mercapto-2-[[(E)-3-(4-methoxyphenyl)acryloyl]amino]propionic acid Formula: C13H15NO4S MolecularWeight: 281.3275

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(=O)NC(CS)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C(=O)NC(CS)C(=O)O

InChI

InChI=1S/C13H15NO4S/c1-18-10-5-2-9(3-6-10)4-7-12(15)14-11(8-19)13(16)17/h2-7,11,19H,8H2,1H3,(H,14,15)(H,16,17)/b7-4+