[1-[[2-[[4-chloranyl-2-(2-chlorophenyl)carbonyl-phenyl]-methyl-amino]-2-oxidanylidene-ethyl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]azanium chloride

Systemtic Name: [1-[[2-[[4-chloranyl-2-(2-chlorophenyl)carbonyl-phenyl]-methyl-amino]-2-oxidanylidene-ethyl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]azanium chloride Openeye Name: [1-[[2-[4-chloro-2-(2-chlorobenzoyl)-N-methyl-anilino]-2-oxo-ethyl]carbamoyl]-2-methyl-propyl]ammonium chloride CAS Name: [1-[[2-[4-chloro-2-[(2-chlorophenyl)-oxomethyl]-N-methylanilino]-2-oxoethyl]amino]-3-methyl-1-oxobutan-2-yl]ammonium chloride IUPAC Name: [1-[[2-[4-chloro-2-(2-chlorobenzoyl)-N-methylanilino]-2-oxoethyl]amino]-3-methyl-1-oxobutan-2-yl]azanium chloride Traditional Name: [1-[[2-[4-chloro-2-(2-chlorobenzoyl)-N-methyl-anilino]-2-keto-ethyl]carbamoyl]-2-methyl-propyl]ammonium chloride Formula: C21H24Cl3N3O3 MolecularWeight: 472.79256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC(=O)N(C)C1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2Cl)[NH3+].[Cl-]

Isomeric SMILES

CC(C)C(C(=O)NCC(=O)N(C)C1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2Cl)[NH3+].[Cl-]

InChI

InChI=1S/C21H23Cl2N3O3.ClH/c1-12(2)19(24)21(29)25-11-18(27)26(3)17-9-8-13(22)10-15(17)20(28)14-6-4-5-7-16(14)23;/h4-10,12,19H,11,24H2,1-3H3,(H,25,29);1H