[3-chloranyl-5-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methyl-[(1R)-1-phenylethyl]azanium

Systemtic Name: [3-chloranyl-5-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methyl-[(1R)-1-phenylethyl]azanium Openeye Name: [3-chloro-5-methoxy-4-(3-pyridylmethoxy)phenyl]methyl-[(1R)-1-phenylethyl]ammonium CAS Name: [3-chloro-5-methoxy-4-(3-pyridinylmethoxy)phenyl]methyl-[(1R)-1-phenylethyl]ammonium IUPAC Name: [3-chloro-5-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methyl-[(1R)-1-phenylethyl]azanium Traditional Name: [3-chloro-5-methoxy-4-(3-pyridylmethoxy)benzyl]-[(1R)-1-phenylethyl]ammonium Formula: C22H24ClN2O2+ MolecularWeight: 383.89116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH2+]CC2=CC(=C(C(=C2)Cl)OCC3=CN=CC=C3)OC

Isomeric SMILES

C[C@H](C1=CC=CC=C1)[NH2+]CC2=CC(=C(C(=C2)Cl)OCC3=CN=CC=C3)OC

InChI

InChI=1S/C22H23ClN2O2/c1-16(19-8-4-3-5-9-19)25-14-18-11-20(23)22(21(12-18)26-2)27-15-17-7-6-10-24-13-17/h3-13,16,25H,14-15H2,1-2H3/p+1/t16-/m1/s1