sodium 4-[(2-chloranyl-6-methyl-phenyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: sodium 4-[(2-chloranyl-6-methyl-phenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: sodium 4-(2-chloro-6-methyl-anilino)-4-oxo-butanoic acid CAS Name: sodium 4-(2-chloro-6-methylanilino)-4-oxobutanoic acid IUPAC Name: sodium 4-(2-chloro-6-methylanilino)-4-oxobutanoic acid Traditional Name: sodium 4-(2-chloro-6-methyl-anilino)-4-keto-butyric acid Formula: C11H12ClNNaO3+ MolecularWeight: 264.66065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)Cl)NC(=O)CCC(=O)O.[Na+]

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)NC(=O)CCC(=O)O.[Na+]

InChI

InChI=1S/C11H12ClNO3.Na/c1-7-3-2-4-8(12)11(7)13-9(14)5-6-10(15)16;/h2-4H,5-6H2,1H3,(H,13,14)(H,15,16);/q;+1