[(1S)-3-azaniumyl-1-(3-methoxy-2-oxidanyl-phenyl)propyl]-methyl-(phenylmethyl)azanium

Systemtic Name: [(1S)-3-azaniumyl-1-(3-methoxy-2-oxidanyl-phenyl)propyl]-methyl-(phenylmethyl)azanium Openeye Name: [(1S)-3-azaniumyl-1-(2-hydroxy-3-methoxy-phenyl)propyl]-benzyl-methyl-ammonium CAS Name: [(1S)-3-ammonio-1-(2-hydroxy-3-methoxyphenyl)propyl]-methyl-(phenylmethyl)ammonium IUPAC Name: [(1S)-3-azaniumyl-1-(2-hydroxy-3-methoxyphenyl)propyl]-benzyl-methylazanium Traditional Name: [(1S)-3-ammonio-1-(2-hydroxy-3-methoxy-phenyl)propyl]-benzyl-methyl-ammonium Formula: C18H26N2O2+2 MolecularWeight: 302.41124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)C(CC[NH3+])C2=C(C(=CC=C2)OC)O

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)[C@@H](CC[NH3+])C2=C(C(=CC=C2)OC)O

InChI

InChI=1S/C18H24N2O2/c1-20(13-14-7-4-3-5-8-14)16(11-12-19)15-9-6-10-17(22-2)18(15)21/h3-10,16,21H,11-13,19H2,1-2H3/p+2/t16-/m0/s1