10-(4-chlorophenyl)-5-methyl-3-(quinolin-2-ylmethoxy)-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole-7-carboxylic acid

Systemtic Name: 10-(4-chlorophenyl)-5-methyl-3-(quinolin-2-ylmethoxy)-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole-7-carboxylic acid Openeye Name: 10-(4-chlorophenyl)-5-methyl-3-(2-quinolylmethoxy)-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole-7-carboxylic acid CAS Name: 10-(4-chlorophenyl)-5-methyl-3-(2-quinolinylmethoxy)-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole-7-carboxylic acid IUPAC Name: 10-(4-chlorophenyl)-5-methyl-3-(quinolin-2-ylmethoxy)-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole-7-carboxylic acid Traditional Name: 10-(4-chlorophenyl)-5-methyl-3-(2-quinolylmethoxy)-7,8,9,10-tetrahydro-6H-cyclohept[b]indole-7-carboxylic acid Formula: C31H27ClN2O3 MolecularWeight: 511.01068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(CCC(C2)C(=O)O)C3=CC=C(C=C3)Cl)C4=C1C=C(C=C4)OCC5=NC6=CC=CC=C6C=C5

Isomeric SMILES

CN1C2=C(C(CCC(C2)C(=O)O)C3=CC=C(C=C3)Cl)C4=C1C=C(C=C4)OCC5=NC6=CC=CC=C6C=C5

InChI

InChI=1S/C31H27ClN2O3/c1-34-28-17-24(37-18-23-12-8-20-4-2-3-5-27(20)33-23)13-15-26(28)30-25(19-6-10-22(32)11-7-19)14-9-21(31(35)36)16-29(30)34/h2-8,10-13,15,17,21,25H,9,14,16,18H2,1H3,(H,35,36)