2-[(5,6-dimethoxy-2,3-dihydro-1H-inden-1-yl)-(3-ethanoylsulfanyl-2-methyl-propanoyl)amino]ethanoic acid

Systemtic Name: 2-[(5,6-dimethoxy-2,3-dihydro-1H-inden-1-yl)-(3-ethanoylsulfanyl-2-methyl-propanoyl)amino]ethanoic acid Openeye Name: 2-[(3-acetylsulfanyl-2-methyl-propanoyl)-(5,6-dimethoxyindan-1-yl)amino]acetic acid CAS Name: 2-[[3-(acetylthio)-2-methyl-1-oxopropyl]-(5,6-dimethoxy-2,3-dihydro-1H-inden-1-yl)amino]acetic acid IUPAC Name: 2-[(3-acetylsulfanyl-2-methylpropanoyl)-(5,6-dimethoxy-2,3-dihydro-1H-inden-1-yl)amino]acetic acid Traditional Name: 2-[[3-(acetylthio)-2-methyl-propanoyl]-(5,6-dimethoxyindan-1-yl)amino]acetic acid Formula: C19H25NO6S MolecularWeight: 395.4699

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(=O)N(CC(=O)O)C1CCC2=CC(=C(C=C12)OC)OC

Isomeric SMILES

CC(CSC(=O)C)C(=O)N(CC(=O)O)C1CCC2=CC(=C(C=C12)OC)OC

InChI

InChI=1S/C19H25NO6S/c1-11(10-27-12(2)21)19(24)20(9-18(22)23)15-6-5-13-7-16(25-3)17(26-4)8-14(13)15/h7-8,11,15H,5-6,9-10H2,1-4H3,(H,22,23)