ethyl 4-[4-(5-methyl-2-quinolin-2-yl-1H-indol-3-yl)butanoylamino]benzoate

Systemtic Name: ethyl 4-[4-(5-methyl-2-quinolin-2-yl-1H-indol-3-yl)butanoylamino]benzoate Openeye Name: ethyl 4-[4-[5-methyl-2-(2-quinolyl)-1H-indol-3-yl]butanoylamino]benzoate CAS Name: 4-[[4-[5-methyl-2-(2-quinolinyl)-1H-indol-3-yl]-1-oxobutyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(5-methyl-2-quinolin-2-yl-1H-indol-3-yl)butanoylamino]benzoate Traditional Name: 4-[4-[5-methyl-2-(2-quinolyl)-1H-indol-3-yl]butanoylamino]benzoic acid ethyl ester Formula: C31H29N3O3 MolecularWeight: 491.58026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCCC2=C(NC3=C2C=C(C=C3)C)C4=NC5=CC=CC=C5C=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCCC2=C(NC3=C2C=C(C=C3)C)C4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C31H29N3O3/c1-3-37-31(36)22-12-15-23(16-13-22)32-29(35)10-6-8-24-25-19-20(2)11-17-27(25)34-30(24)28-18-14-21-7-4-5-9-26(21)33-28/h4-5,7,9,11-19,34H,3,6,8,10H2,1-2H3,(H,32,35)