[(2S)-2-(1H-indol-3-yl)-3-(3-methoxy-4-oxidanyl-phenyl)propyl]azanium

Systemtic Name: [(2S)-2-(1H-indol-3-yl)-3-(3-methoxy-4-oxidanyl-phenyl)propyl]azanium Openeye Name: [(2S)-3-(4-hydroxy-3-methoxy-phenyl)-2-(1H-indol-3-yl)propyl]ammonium CAS Name: [(2S)-3-(4-hydroxy-3-methoxyphenyl)-2-(1H-indol-3-yl)propyl]ammonium IUPAC Name: [(2S)-3-(4-hydroxy-3-methoxyphenyl)-2-(1H-indol-3-yl)propyl]azanium Traditional Name: [(2S)-3-(4-hydroxy-3-methoxy-phenyl)-2-(1H-indol-3-yl)propyl]ammonium Formula: C18H21N2O2+ MolecularWeight: 297.37154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC(C[NH3+])C2=CNC3=CC=CC=C32)O

Isomeric SMILES

COC1=C(C=CC(=C1)C[C@H](C[NH3+])C2=CNC3=CC=CC=C32)O

InChI

InChI=1S/C18H20N2O2/c1-22-18-9-12(6-7-17(18)21)8-13(10-19)15-11-20-16-5-3-2-4-14(15)16/h2-7,9,11,13,20-21H,8,10,19H2,1H3/p+1/t13-/m1/s1