2-[[2-[[4-chloranyl-2-(phenylcarbonyl)phenyl]amino]-2-oxidanylidene-ethyl]azaniumyl]ethyl-diethyl-azanium

Systemtic Name: 2-[[2-[[4-chloranyl-2-(phenylcarbonyl)phenyl]amino]-2-oxidanylidene-ethyl]azaniumyl]ethyl-diethyl-azanium Openeye Name: 2-[[2-(2-benzoyl-4-chloro-anilino)-2-oxo-ethyl]ammonio]ethyl-diethyl-ammonium CAS Name: 2-[[2-(2-benzoyl-4-chloroanilino)-2-oxoethyl]ammonio]ethyl-diethylammonium IUPAC Name: 2-[[2-(2-benzoyl-4-chloroanilino)-2-oxoethyl]azaniumyl]ethyl-diethylazanium Traditional Name: 2-[[2-(2-benzoyl-4-chloro-anilino)-2-keto-ethyl]ammonio]ethyl-diethyl-ammonium Formula: C21H28ClN3O2+2 MolecularWeight: 389.91892

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC[NH2+]CC(=O)NC1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2

Isomeric SMILES

CC[NH+](CC)CC[NH2+]CC(=O)NC1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H26ClN3O2/c1-3-25(4-2)13-12-23-15-20(26)24-19-11-10-17(22)14-18(19)21(27)16-8-6-5-7-9-16/h5-11,14,23H,3-4,12-13,15H2,1-2H3,(H,24,26)/p+2