(2R)-4-[(4-ethoxyphenyl)amino]-2-(2-methylpropylazaniumyl)-4-oxidanylidene-butanoate

Systemtic Name: (2R)-4-[(4-ethoxyphenyl)amino]-2-(2-methylpropylazaniumyl)-4-oxidanylidene-butanoate Openeye Name: (2R)-4-(4-ethoxyanilino)-2-(isobutylammonio)-4-oxo-butanoate CAS Name: (2R)-4-(4-ethoxyanilino)-2-(2-methylpropylammonio)-4-oxobutanoate IUPAC Name: (2R)-4-(4-ethoxyanilino)-2-(2-methylpropylazaniumyl)-4-oxobutanoate Traditional Name: (2R)-2-(isobutylammonio)-4-keto-4-(p-phenetidino)butyrate Formula: C16H24N2O4 MolecularWeight: 308.37276

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CC(C(=O)[O-])[NH2+]CC(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C[C@H](C(=O)[O-])[NH2+]CC(C)C

InChI

InChI=1S/C16H24N2O4/c1-4-22-13-7-5-12(6-8-13)18-15(19)9-14(16(20)21)17-10-11(2)3/h5-8,11,14,17H,4,9-10H2,1-3H3,(H,18,19)(H,20,21)/t14-/m1/s1