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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(CC(C)C)C(=O)CCC(=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1CN(CC(C)C)C(=O)CCC(=O)[O-]

InChI

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