[3-(2,3-diphenylbenzo[g]indol-1-yl)-2-oxidanyl-propyl]-phenyl-azanium chloride

Systemtic Name: [3-(2,3-diphenylbenzo[g]indol-1-yl)-2-oxidanyl-propyl]-phenyl-azanium chloride Openeye Name: [3-(2,3-diphenylbenzo[g]indol-1-yl)-2-hydroxy-propyl]-phenyl-ammonium chloride CAS Name: [3-(2,3-diphenyl-1-benzo[g]indolyl)-2-hydroxypropyl]-phenylammonium chloride IUPAC Name: [3-(2,3-diphenylbenzo[g]indol-1-yl)-2-hydroxypropyl]-phenylazanium chloride Traditional Name: [3-(2,3-diphenylbenz[g]indol-1-yl)-2-hydroxy-propyl]-phenyl-ammonium chloride Formula: C33H29ClN2O MolecularWeight: 505.04916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N(C3=C2C=CC4=CC=CC=C43)CC(C[NH2+]C5=CC=CC=C5)O)C6=CC=CC=C6.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N(C3=C2C=CC4=CC=CC=C43)CC(C[NH2+]C5=CC=CC=C5)O)C6=CC=CC=C6.[Cl-]

InChI

InChI=1S/C33H28N2O.ClH/c36-28(22-34-27-17-8-3-9-18-27)23-35-32(26-15-6-2-7-16-26)31(25-13-4-1-5-14-25)30-21-20-24-12-10-11-19-29(24)33(30)35;/h1-21,28,34,36H,22-23H2;1H