4-[(4-methylphenyl)methyl-(2-methylpropyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(4-methylphenyl)methyl-(2-methylpropyl)amino]-4-oxidanylidene-butanoate Openeye Name: 4-[isobutyl(p-tolylmethyl)amino]-4-oxo-butanoate CAS Name: 4-[(4-methylphenyl)methyl-(2-methylpropyl)amino]-4-oxobutanoate IUPAC Name: 4-[(4-methylphenyl)methyl-(2-methylpropyl)amino]-4-oxobutanoate Traditional Name: 4-[isobutyl-(4-methylbenzyl)amino]-4-keto-butyrate Formula: C16H22NO3- MolecularWeight: 276.35078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CC(C)C)C(=O)CCC(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CN(CC(C)C)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C16H23NO3/c1-12(2)10-17(15(18)8-9-16(19)20)11-14-6-4-13(3)5-7-14/h4-7,12H,8-11H2,1-3H3,(H,19,20)/p-1