2-[(4-phenylmethoxyphenyl)methyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium

Systemtic Name: 2-[(4-phenylmethoxyphenyl)methyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium Openeye Name: 2-[(4-benzyloxyphenyl)methyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium CAS Name: 2-[(4-phenylmethoxyphenyl)methyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium IUPAC Name: 2-[(4-phenylmethoxyphenyl)methyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium Traditional Name: 2-(4-benzoxybenzyl)-2,3,4,9-tetrahydro-1H-$b-carbolin-2-ium Formula: C25H25N2O+ MolecularWeight: 369.4788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=C1C3=CC=CC=C3N2)CC4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1C[NH+](CC2=C1C3=CC=CC=C3N2)CC4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C25H24N2O/c1-2-6-20(7-3-1)18-28-21-12-10-19(11-13-21)16-27-15-14-23-22-8-4-5-9-24(22)26-25(23)17-27/h1-13,26H,14-18H2/p+1