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

Systemtic Name: dimethyl 5-[4-(5-chloranyl-2-quinolin-2-yl-1H-indol-3-yl)butanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[4-[5-chloro-2-(2-quinolyl)-1H-indol-3-yl]butanoylamino]benzene-1,3-dicarboxylate CAS Name: 5-[[4-[5-chloro-2-(2-quinolinyl)-1H-indol-3-yl]-1-oxobutyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[4-(5-chloro-2-quinolin-2-yl-1H-indol-3-yl)butanoylamino]benzene-1,3-dicarboxylate Traditional Name: 5-[4-[5-chloro-2-(2-quinolyl)-1H-indol-3-yl]butanoylamino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C31H26ClN3O5 MolecularWeight: 556.00824

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)CCCC2=C(NC3=C2C=C(C=C3)Cl)C4=NC5=CC=CC=C5C=C4)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)CCCC2=C(NC3=C2C=C(C=C3)Cl)C4=NC5=CC=CC=C5C=C4)C(=O)OC

InChI

InChI=1S/C31H26ClN3O5/c1-39-30(37)19-14-20(31(38)40-2)16-22(15-19)33-28(36)9-5-7-23-24-17-21(32)11-13-26(24)35-29(23)27-12-10-18-6-3-4-8-25(18)34-27/h3-4,6,8,10-17,35H,5,7,9H2,1-2H3,(H,33,36)