3-[[3-[(2,4-dichlorophenyl)carbonylamino]phenyl]methylazaniumyl]propyl-diethyl-azanium

Systemtic Name: 3-[[3-[(2,4-dichlorophenyl)carbonylamino]phenyl]methylazaniumyl]propyl-diethyl-azanium Openeye Name: 3-[[3-[(2,4-dichlorobenzoyl)amino]phenyl]methylammonio]propyl-diethyl-ammonium CAS Name: 3-[[3-[[(2,4-dichlorophenyl)-oxomethyl]amino]phenyl]methylammonio]propyl-diethylammonium IUPAC Name: 3-[[3-[(2,4-dichlorobenzoyl)amino]phenyl]methylazaniumyl]propyl-diethylazanium Traditional Name: 3-[[3-[(2,4-dichlorobenzoyl)amino]benzyl]ammonio]propyl-diethyl-ammonium Formula: C21H29Cl2N3O+2 MolecularWeight: 410.38046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC[NH2+]CC1=CC(=CC=C1)NC(=O)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC[NH+](CC)CCC[NH2+]CC1=CC(=CC=C1)NC(=O)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C21H27Cl2N3O/c1-3-26(4-2)12-6-11-24-15-16-7-5-8-18(13-16)25-21(27)19-10-9-17(22)14-20(19)23/h5,7-10,13-14,24H,3-4,6,11-12,15H2,1-2H3,(H,25,27)/p+2