5-[(4-methoxyphenyl)amino]-3,3-dimethyl-5-oxidanylidene-pentanoate

Systemtic Name: 5-[(4-methoxyphenyl)amino]-3,3-dimethyl-5-oxidanylidene-pentanoate Openeye Name: 5-(4-methoxyanilino)-3,3-dimethyl-5-oxo-pentanoate CAS Name: 5-(4-methoxyanilino)-3,3-dimethyl-5-oxopentanoate IUPAC Name: 5-(4-methoxyanilino)-3,3-dimethyl-5-oxopentanoate Traditional Name: 5-keto-3,3-dimethyl-5-(p-anisidino)valerate Formula: C14H18NO4- MolecularWeight: 264.29702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO4/c1-14(2,9-13(17)18)8-12(16)15-10-4-6-11(19-3)7-5-10/h4-7H,8-9H2,1-3H3,(H,15,16)(H,17,18)/p-1