2-[(3-ethanoylsulfanyl-2-methyl-propanoyl)-[4-(2-methoxy-2-oxidanylidene-ethoxy)phenyl]amino]ethanoic acid

Systemtic Name: 2-[(3-ethanoylsulfanyl-2-methyl-propanoyl)-[4-(2-methoxy-2-oxidanylidene-ethoxy)phenyl]amino]ethanoic acid Openeye Name: 2-[N-(3-acetylsulfanyl-2-methyl-propanoyl)-4-(2-methoxy-2-oxo-ethoxy)anilino]acetic acid CAS Name: 2-[N-[3-(acetylthio)-2-methyl-1-oxopropyl]-4-(2-methoxy-2-oxoethoxy)anilino]acetic acid IUPAC Name: 2-[N-(3-acetylsulfanyl-2-methylpropanoyl)-4-(2-methoxy-2-oxoethoxy)anilino]acetic acid Traditional Name: 2-[N-[3-(acetylthio)-2-methyl-propanoyl]-4-(2-keto-2-methoxy-ethoxy)anilino]acetic acid Formula: C17H21NO7S MolecularWeight: 383.41614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO7S/c1-11(10-26-12(2)19)17(23)18(8-15(20)21)13-4-6-14(7-5-13)25-9-16(22)24-3/h4-7,11H,8-10H2,1-3H3,(H,20,21)