3,3-dimethyl-5-oxidanylidene-5-phenylazanyl-pentanoate

Systemtic Name: 3,3-dimethyl-5-oxidanylidene-5-phenylazanyl-pentanoate Openeye Name: 5-anilino-3,3-dimethyl-5-oxo-pentanoate CAS Name: 5-anilino-3,3-dimethyl-5-oxopentanoate IUPAC Name: 5-anilino-3,3-dimethyl-5-oxopentanoate Traditional Name: 5-anilino-5-keto-3,3-dimethyl-valerate Formula: C13H16NO3- MolecularWeight: 234.27104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)NC1=CC=CC=C1)CC(=O)[O-]

Isomeric SMILES

CC(C)(CC(=O)NC1=CC=CC=C1)CC(=O)[O-]

InChI

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