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

Systemtic Name: 3-[[2-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]methylazaniumyl]propyl-diethyl-azanium Openeye Name: 3-[[2-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]methylammonio]propyl-diethyl-ammonium CAS Name: 3-[[2-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methylammonio]propyl-diethylammonium IUPAC Name: 3-[[2-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methylazaniumyl]propyl-diethylazanium Traditional Name: 3-[[2-(4-chlorobenzyl)oxy-3-methoxy-benzyl]ammonio]propyl-diethyl-ammonium Formula: C22H33ClN2O2+2 MolecularWeight: 392.96262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H31ClN2O2/c1-4-25(5-2)15-7-14-24-16-19-8-6-9-21(26-3)22(19)27-17-18-10-12-20(23)13-11-18/h6,8-13,24H,4-5,7,14-17H2,1-3H3/p+2