3-[3-[(2-methoxyphenyl)amino]-3-oxidanylidene-propyl]sulfanylpropanoic acid

Systemtic Name: 3-[3-[(2-methoxyphenyl)amino]-3-oxidanylidene-propyl]sulfanylpropanoic acid Openeye Name: 3-[3-(2-methoxyanilino)-3-oxo-propyl]sulfanylpropanoic acid CAS Name: 3-[[3-(2-methoxyanilino)-3-oxopropyl]thio]propanoic acid IUPAC Name: 3-[3-(2-methoxyanilino)-3-oxopropyl]sulfanylpropanoic acid Traditional Name: 3-[[3-keto-3-(o-anisidino)propyl]thio]propionic acid Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)CCSCCC(=O)O

Isomeric SMILES

COC1=CC=CC=C1NC(=O)CCSCCC(=O)O

InChI

InChI=1S/C13H17NO4S/c1-18-11-5-3-2-4-10(11)14-12(15)6-8-19-9-7-13(16)17/h2-5H,6-9H2,1H3,(H,14,15)(H,16,17)