2-[[2-[(2-chloranyl-4,6-dimethyl-phenyl)amino]-2-oxidanylidene-ethyl]amino]-3-methyl-butanoic acid

Systemtic Name: 2-[[2-[(2-chloranyl-4,6-dimethyl-phenyl)amino]-2-oxidanylidene-ethyl]amino]-3-methyl-butanoic acid Openeye Name: 2-[[2-(2-chloro-4,6-dimethyl-anilino)-2-oxo-ethyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-(2-chloro-4,6-dimethylanilino)-2-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-(2-chloro-4,6-dimethylanilino)-2-oxoethyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-(2-chloro-4,6-dimethyl-anilino)-2-keto-ethyl]amino]-3-methyl-butyric acid Formula: C15H21ClN2O3 MolecularWeight: 312.79184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=O)CNC(C(C)C)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=O)CNC(C(C)C)C(=O)O)C

InChI

InChI=1S/C15H21ClN2O3/c1-8(2)13(15(20)21)17-7-12(19)18-14-10(4)5-9(3)6-11(14)16/h5-6,8,13,17H,7H2,1-4H3,(H,18,19)(H,20,21)