[2-[[4-bromanyl-2-(4-chlorophenyl)carbonyl-phenyl]amino]-2-oxidanylidene-ethyl]-triethyl-azanium bromide

Systemtic Name: [2-[[4-bromanyl-2-(4-chlorophenyl)carbonyl-phenyl]amino]-2-oxidanylidene-ethyl]-triethyl-azanium bromide Openeye Name: [2-[4-bromo-2-(4-chlorobenzoyl)anilino]-2-oxo-ethyl]-triethyl-ammonium bromide CAS Name: [2-[4-bromo-2-[(4-chlorophenyl)-oxomethyl]anilino]-2-oxoethyl]-triethylammonium bromide IUPAC Name: [2-[4-bromo-2-(4-chlorobenzoyl)anilino]-2-oxoethyl]-triethylazanium bromide Traditional Name: [2-[4-bromo-2-(4-chlorobenzoyl)anilino]-2-keto-ethyl]-triethyl-ammonium bromide Formula: C21H25Br2ClN2O2 MolecularWeight: 532.6964

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC)CC(=O)NC1=C(C=C(C=C1)Br)C(=O)C2=CC=C(C=C2)Cl.[Br-]

Isomeric SMILES

CC[N+](CC)(CC)CC(=O)NC1=C(C=C(C=C1)Br)C(=O)C2=CC=C(C=C2)Cl.[Br-]

InChI

InChI=1S/C21H24BrClN2O2.BrH/c1-4-25(5-2,6-3)14-20(26)24-19-12-9-16(22)13-18(19)21(27)15-7-10-17(23)11-8-15;/h7-13H,4-6,14H2,1-3H3;1H