5-[(2,6-dimethylphenyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: 5-[(2,6-dimethylphenyl)amino]-5-oxidanylidene-pentanoate Openeye Name: 5-(2,6-dimethylanilino)-5-oxo-pentanoate CAS Name: 5-(2,6-dimethylanilino)-5-oxopentanoate IUPAC Name: 5-(2,6-dimethylanilino)-5-oxopentanoate Traditional Name: 5-(2,6-dimethylanilino)-5-keto-valerate Formula: C13H16NO3- MolecularWeight: 234.27104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CCCC(=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CCCC(=O)[O-]

InChI

InChI=1S/C13H17NO3/c1-9-5-3-6-10(2)13(9)14-11(15)7-4-8-12(16)17/h3,5-6H,4,7-8H2,1-2H3,(H,14,15)(H,16,17)/p-1