2-[(3R)-1-methyl-2-oxidanylidene-3H-indol-3-yl]propanedioic acid

Systemtic Name: 2-[(3R)-1-methyl-2-oxidanylidene-3H-indol-3-yl]propanedioic acid Openeye Name: 2-[(3R)-1-methyl-2-oxo-indolin-3-yl]propanedioic acid CAS Name: 2-[(3R)-1-methyl-2-oxo-3H-indol-3-yl]propanedioic acid IUPAC Name: 2-[(3R)-1-methyl-2-oxo-3H-indol-3-yl]propanedioic acid Traditional Name: 2-[(3R)-2-keto-1-methyl-indolin-3-yl]malonic acid Formula: C12H11NO5 MolecularWeight: 249.21944

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(C1=O)C(C(=O)O)C(=O)O

Isomeric SMILES

CN1C2=CC=CC=C2[C@H](C1=O)C(C(=O)O)C(=O)O

InChI

InChI=1S/C12H11NO5/c1-13-7-5-3-2-4-6(7)8(10(13)14)9(11(15)16)12(17)18/h2-5,8-9H,1H3,(H,15,16)(H,17,18)/t8-/m0/s1