[3-(4-chlorophenyl)-2-(methylamino)-3-oxidanylidene-propanoyl]-cyclohexyl-methyl-phenyl-azanium

Systemtic Name: [3-(4-chlorophenyl)-2-(methylamino)-3-oxidanylidene-propanoyl]-cyclohexyl-methyl-phenyl-azanium Openeye Name: [3-(4-chlorophenyl)-2-(methylamino)-3-oxo-propanoyl]-cyclohexyl-methyl-phenyl-ammonium CAS Name: [3-(4-chlorophenyl)-2-(methylamino)-1,3-dioxopropyl]-cyclohexyl-methyl-phenylammonium IUPAC Name: [3-(4-chlorophenyl)-2-(methylamino)-3-oxopropanoyl]-cyclohexyl-methyl-phenylazanium Traditional Name: [3-(4-chlorophenyl)-3-keto-2-(methylamino)propanoyl]-cyclohexyl-methyl-phenyl-ammonium Formula: C23H28ClN2O2+ MolecularWeight: 399.93362

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Descriptors Computed from Structure

Canonical SMILES:

CNC(C(=O)C1=CC=C(C=C1)Cl)C(=O)[N+](C)(C2CCCCC2)C3=CC=CC=C3

Isomeric SMILES

CNC(C(=O)C1=CC=C(C=C1)Cl)C(=O)[N+](C)(C2CCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C23H28ClN2O2/c1-25-21(22(27)17-13-15-18(24)16-14-17)23(28)26(2,19-9-5-3-6-10-19)20-11-7-4-8-12-20/h3,5-6,9-10,13-16,20-21,25H,4,7-8,11-12H2,1-2H3/q+1