sodium 4-(2-methyl-1H-indol-3-yl)-4-oxidanylidene-butanoate

Systemtic Name: sodium 4-(2-methyl-1H-indol-3-yl)-4-oxidanylidene-butanoate Openeye Name: sodium 4-(2-methyl-1H-indol-3-yl)-4-oxo-butanoate CAS Name: sodium 4-(2-methyl-1H-indol-3-yl)-4-oxobutanoate IUPAC Name: sodium 4-(2-methyl-1H-indol-3-yl)-4-oxobutanoate Traditional Name: sodium 4-keto-4-(2-methyl-1H-indol-3-yl)butyrate Formula: C13H12NNaO3 MolecularWeight: 253.22905

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)CCC(=O)[O-].[Na+]

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)CCC(=O)[O-].[Na+]

InChI

InChI=1S/C13H13NO3.Na/c1-8-13(11(15)6-7-12(16)17)9-4-2-3-5-10(9)14-8;/h2-5,14H,6-7H2,1H3,(H,16,17);/q;+1/p-1