3-[[5-chloranyl-2-[(4-chlorophenyl)methoxy]phenyl]methylazaniumyl]propyl-diethyl-azanium

Systemtic Name: 3-[[5-chloranyl-2-[(4-chlorophenyl)methoxy]phenyl]methylazaniumyl]propyl-diethyl-azanium Openeye Name: 3-[[5-chloro-2-[(4-chlorophenyl)methoxy]phenyl]methylammonio]propyl-diethyl-ammonium CAS Name: 3-[[5-chloro-2-[(4-chlorophenyl)methoxy]phenyl]methylammonio]propyl-diethylammonium IUPAC Name: 3-[[5-chloro-2-[(4-chlorophenyl)methoxy]phenyl]methylazaniumyl]propyl-diethylazanium Traditional Name: 3-[[5-chloro-2-(4-chlorobenzyl)oxy-benzyl]ammonio]propyl-diethyl-ammonium Formula: C21H30Cl2N2O+2 MolecularWeight: 397.3817

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC[NH2+]CC1=C(C=CC(=C1)Cl)OCC2=CC=C(C=C2)Cl

Isomeric SMILES

CC[NH+](CC)CCC[NH2+]CC1=C(C=CC(=C1)Cl)OCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H28Cl2N2O/c1-3-25(4-2)13-5-12-24-15-18-14-20(23)10-11-21(18)26-16-17-6-8-19(22)9-7-17/h6-11,14,24H,3-5,12-13,15-16H2,1-2H3/p+2