[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-(2-methylpropyl)azanium chloride

Systemtic Name: [2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-(2-methylpropyl)azanium chloride Openeye Name: [2-(3-chloro-2-methyl-anilino)-2-oxo-ethyl]-isobutyl-ammonium chloride CAS Name: [2-(3-chloro-2-methylanilino)-2-oxoethyl]-(2-methylpropyl)ammonium chloride IUPAC Name: [2-(3-chloro-2-methylanilino)-2-oxoethyl]-(2-methylpropyl)azanium chloride Traditional Name: [2-(3-chloro-2-methyl-anilino)-2-keto-ethyl]-isobutyl-ammonium chloride Formula: C13H20Cl2N2O MolecularWeight: 291.2167

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C[NH2+]CC(C)C.[Cl-]

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C[NH2+]CC(C)C.[Cl-]

InChI

InChI=1S/C13H19ClN2O.ClH/c1-9(2)7-15-8-13(17)16-12-6-4-5-11(14)10(12)3;/h4-6,9,15H,7-8H2,1-3H3,(H,16,17);1H