(2R)-2-(butylazaniumyl)-4-oxidanylidene-4-[(2,4,6-trimethylphenyl)amino]butanoate

Systemtic Name: (2R)-2-(butylazaniumyl)-4-oxidanylidene-4-[(2,4,6-trimethylphenyl)amino]butanoate Openeye Name: (2R)-2-(butylammonio)-4-oxo-4-(2,4,6-trimethylanilino)butanoate CAS Name: (2R)-2-(butylammonio)-4-oxo-4-(2,4,6-trimethylanilino)butanoate IUPAC Name: (2R)-2-(butylazaniumyl)-4-oxo-4-(2,4,6-trimethylanilino)butanoate Traditional Name: (2R)-2-(butylammonio)-4-keto-4-mesidino-butyrate Formula: C17H26N2O3 MolecularWeight: 306.39994

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH2+]C(CC(=O)NC1=C(C=C(C=C1C)C)C)C(=O)[O-]

Isomeric SMILES

CCCC[NH2+][C@H](CC(=O)NC1=C(C=C(C=C1C)C)C)C(=O)[O-]

InChI

InChI=1S/C17H26N2O3/c1-5-6-7-18-14(17(21)22)10-15(20)19-16-12(3)8-11(2)9-13(16)4/h8-9,14,18H,5-7,10H2,1-4H3,(H,19,20)(H,21,22)/t14-/m1/s1