dibutyl-[3-[[3-[(4-chlorophenyl)methoxy]phenyl]methylazaniumyl]propyl]azanium

Systemtic Name: dibutyl-[3-[[3-[(4-chlorophenyl)methoxy]phenyl]methylazaniumyl]propyl]azanium Openeye Name: dibutyl-[3-[[3-[(4-chlorophenyl)methoxy]phenyl]methylammonio]propyl]ammonium CAS Name: dibutyl-[3-[[3-[(4-chlorophenyl)methoxy]phenyl]methylammonio]propyl]ammonium IUPAC Name: dibutyl-[3-[[3-[(4-chlorophenyl)methoxy]phenyl]methylazaniumyl]propyl]azanium Traditional Name: dibutyl-[3-[[3-(4-chlorobenzyl)oxybenzyl]ammonio]propyl]ammonium Formula: C25H39ClN2O+2 MolecularWeight: 419.04296

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H37ClN2O/c1-3-5-16-28(17-6-4-2)18-8-15-27-20-23-9-7-10-25(19-23)29-21-22-11-13-24(26)14-12-22/h7,9-14,19,27H,3-6,8,15-18,20-21H2,1-2H3/p+2