(2-chlorophenyl)methyl-(3-imidazol-1-ylpropyl)-[(3-methoxyphenyl)methyl]azanium

Systemtic Name: (2-chlorophenyl)methyl-(3-imidazol-1-ylpropyl)-[(3-methoxyphenyl)methyl]azanium Openeye Name: (2-chlorophenyl)methyl-(3-imidazol-1-ylpropyl)-[(3-methoxyphenyl)methyl]ammonium CAS Name: (2-chlorophenyl)methyl-[3-(1-imidazolyl)propyl]-[(3-methoxyphenyl)methyl]ammonium IUPAC Name: (2-chlorophenyl)methyl-(3-imidazol-1-ylpropyl)-[(3-methoxyphenyl)methyl]azanium Traditional Name: (2-chlorobenzyl)-(3-imidazol-1-ylpropyl)-m-anisyl-ammonium Formula: C21H25ClN3O+ MolecularWeight: 370.8957

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C[NH+](CCCN2C=CN=C2)CC3=CC=CC=C3Cl

Isomeric SMILES

COC1=CC=CC(=C1)C[NH+](CCCN2C=CN=C2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C21H24ClN3O/c1-26-20-8-4-6-18(14-20)15-25(12-5-11-24-13-10-23-17-24)16-19-7-2-3-9-21(19)22/h2-4,6-10,13-14,17H,5,11-12,15-16H2,1H3/p+1