[4-[(4-chlorophenyl)methoxy]-3-ethoxy-phenyl]methyl-(pyridin-4-ylmethyl)azanium

Systemtic Name: [4-[(4-chlorophenyl)methoxy]-3-ethoxy-phenyl]methyl-(pyridin-4-ylmethyl)azanium Openeye Name: [4-[(4-chlorophenyl)methoxy]-3-ethoxy-phenyl]methyl-(4-pyridylmethyl)ammonium CAS Name: [4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl]methyl-(pyridin-4-ylmethyl)ammonium IUPAC Name: [4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl]methyl-(pyridin-4-ylmethyl)azanium Traditional Name: [4-(4-chlorobenzyl)oxy-3-ethoxy-benzyl]-(4-pyridylmethyl)ammonium Formula: C22H24ClN2O2+ MolecularWeight: 383.89116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]CC2=CC=NC=C2)OCC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]CC2=CC=NC=C2)OCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H23ClN2O2/c1-2-26-22-13-19(15-25-14-17-9-11-24-12-10-17)5-8-21(22)27-16-18-3-6-20(23)7-4-18/h3-13,25H,2,14-16H2,1H3/p+1