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

Systemtic Name: 2-[(5,6-dimethoxy-2,3-dihydro-1H-inden-1-yl)-(2-methyl-3-sulfanyl-propanoyl)amino]ethanoic acid Openeye Name: 2-[(5,6-dimethoxyindan-1-yl)-(2-methyl-3-sulfanyl-propanoyl)amino]acetic acid CAS Name: 2-[(5,6-dimethoxy-2,3-dihydro-1H-inden-1-yl)-(3-mercapto-2-methyl-1-oxopropyl)amino]acetic acid IUPAC Name: 2-[(5,6-dimethoxy-2,3-dihydro-1H-inden-1-yl)-(2-methyl-3-sulfanylpropanoyl)amino]acetic acid Traditional Name: 2-[(5,6-dimethoxyindan-1-yl)-(3-mercapto-2-methyl-propanoyl)amino]acetic acid Formula: C17H23NO5S MolecularWeight: 353.43322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23NO5S/c1-10(9-24)17(21)18(8-16(19)20)13-5-4-11-6-14(22-2)15(23-3)7-12(11)13/h6-7,10,13,24H,4-5,8-9H2,1-3H3,(H,19,20)