dimethyl 5-[4-(2-quinolin-2-yl-1H-indol-3-yl)butanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[4-(2-quinolin-2-yl-1H-indol-3-yl)butanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[4-[2-(2-quinolyl)-1H-indol-3-yl]butanoylamino]benzene-1,3-dicarboxylate CAS Name: 5-[[1-oxo-4-[2-(2-quinolinyl)-1H-indol-3-yl]butyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[4-(2-quinolin-2-yl-1H-indol-3-yl)butanoylamino]benzene-1,3-dicarboxylate Traditional Name: 5-[4-[2-(2-quinolyl)-1H-indol-3-yl]butanoylamino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C31H27N3O5 MolecularWeight: 521.56318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)CCCC2=C(NC3=CC=CC=C32)C4=NC5=CC=CC=C5C=C4)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)CCCC2=C(NC3=CC=CC=C32)C4=NC5=CC=CC=C5C=C4)C(=O)OC

InChI

InChI=1S/C31H27N3O5/c1-38-30(36)20-16-21(31(37)39-2)18-22(17-20)32-28(35)13-7-10-24-23-9-4-6-12-26(23)34-29(24)27-15-14-19-8-3-5-11-25(19)33-27/h3-6,8-9,11-12,14-18,34H,7,10,13H2,1-2H3,(H,32,35)