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

Systemtic Name: 3-[[4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]methylazaniumyl]propyl-diethyl-azanium Openeye Name: 3-[[4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]methylammonio]propyl-diethyl-ammonium CAS Name: 3-[[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methylammonio]propyl-diethylammonium IUPAC Name: 3-[[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methylazaniumyl]propyl-diethylazanium Traditional Name: 3-[[4-(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=CC(=C(C=C1)OCC2=CC=C(C=C2)Cl)OC

Isomeric SMILES

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

InChI

InChI=1S/C22H31ClN2O2/c1-4-25(5-2)14-6-13-24-16-19-9-12-21(22(15-19)26-3)27-17-18-7-10-20(23)11-8-18/h7-12,15,24H,4-6,13-14,16-17H2,1-3H3/p+2