2-(2-acetamido-2,3-dihydro-1H-inden-5-yl)-2-(1-oxidanylidenepropan-2-yl)propanedioic acid

Systemtic Name: 2-(2-acetamido-2,3-dihydro-1H-inden-5-yl)-2-(1-oxidanylidenepropan-2-yl)propanedioic acid Openeye Name: 2-(2-acetamidoindan-5-yl)-2-(1-methyl-2-oxo-ethyl)propanedioic acid CAS Name: 2-(2-acetamido-2,3-dihydro-1H-inden-5-yl)-2-(1-oxopropan-2-yl)propanedioic acid IUPAC Name: 2-(2-acetamido-2,3-dihydro-1H-inden-5-yl)-2-(1-oxopropan-2-yl)propanedioic acid Traditional Name: 2-(2-acetamidoindan-5-yl)-2-(2-keto-1-methyl-ethyl)malonic acid Formula: C17H19NO6 MolecularWeight: 333.33586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=O)C(C1=CC2=C(CC(C2)NC(=O)C)C=C1)(C(=O)O)C(=O)O

Isomeric SMILES

CC(C=O)C(C1=CC2=C(CC(C2)NC(=O)C)C=C1)(C(=O)O)C(=O)O

InChI

InChI=1S/C17H19NO6/c1-9(8-19)17(15(21)22,16(23)24)13-4-3-11-6-14(18-10(2)20)7-12(11)5-13/h3-5,8-9,14H,6-7H2,1-2H3,(H,18,20)(H,21,22)(H,23,24)