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

Systemtic Name: 2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-3-methylsulfanyl-propanoic acid Openeye Name: 2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-3-methylsulfanyl-propanoic acid CAS Name: 2-[[(E)-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]amino]-3-(methylthio)propanoic acid IUPAC Name: 2-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]-3-methylsulfanylpropanoic acid Traditional Name: 2-[[(E)-3-(4-methoxyphenyl)acryloyl]amino]-3-(methylthio)propionic acid Formula: C14H17NO4S MolecularWeight: 295.35408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO4S/c1-19-11-6-3-10(4-7-11)5-8-13(16)15-12(9-20-2)14(17)18/h3-8,12H,9H2,1-2H3,(H,15,16)(H,17,18)/b8-5+