2-[(3-ethanoylsulfanyl-2-methyl-propanoyl)-(3-methoxyphenyl)amino]ethanoic acid

Systemtic Name: 2-[(3-ethanoylsulfanyl-2-methyl-propanoyl)-(3-methoxyphenyl)amino]ethanoic acid Openeye Name: 2-(N-(3-acetylsulfanyl-2-methyl-propanoyl)-3-methoxy-anilino)acetic acid CAS Name: 2-(N-[3-(acetylthio)-2-methyl-1-oxopropyl]-3-methoxyanilino)acetic acid IUPAC Name: 2-(N-(3-acetylsulfanyl-2-methylpropanoyl)-3-methoxyanilino)acetic acid Traditional Name: 2-(N-[3-(acetylthio)-2-methyl-propanoyl]-3-methoxy-anilino)acetic acid Formula: C15H19NO5S MolecularWeight: 325.38006

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(=O)N(CC(=O)O)C1=CC(=CC=C1)OC

Isomeric SMILES

CC(CSC(=O)C)C(=O)N(CC(=O)O)C1=CC(=CC=C1)OC

InChI

InChI=1S/C15H19NO5S/c1-10(9-22-11(2)17)15(20)16(8-14(18)19)12-5-4-6-13(7-12)21-3/h4-7,10H,8-9H2,1-3H3,(H,18,19)