3-[[(Z)-3-(4-ethoxyphenyl)-2-(sulfanylmethyl)prop-2-enoyl]amino]propanoic acid

Systemtic Name: 3-[[(Z)-3-(4-ethoxyphenyl)-2-(sulfanylmethyl)prop-2-enoyl]amino]propanoic acid Openeye Name: 3-[[(Z)-3-(4-ethoxyphenyl)-2-(sulfanylmethyl)prop-2-enoyl]amino]propanoic acid CAS Name: 3-[[(Z)-3-(4-ethoxyphenyl)-2-(mercaptomethyl)-1-oxoprop-2-enyl]amino]propanoic acid IUPAC Name: 3-[[(Z)-3-(4-ethoxyphenyl)-2-(sulfanylmethyl)prop-2-enoyl]amino]propanoic acid Traditional Name: 3-[[(Z)-2-(mercaptomethyl)-3-p-phenetyl-acryloyl]amino]propionic acid Formula: C15H19NO4S MolecularWeight: 309.38066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=C(CS)C(=O)NCCC(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C(\CS)/C(=O)NCCC(=O)O

InChI

InChI=1S/C15H19NO4S/c1-2-20-13-5-3-11(4-6-13)9-12(10-21)15(19)16-8-7-14(17)18/h3-6,9,21H,2,7-8,10H2,1H3,(H,16,19)(H,17,18)/b12-9+