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

Systemtic Name: methyl 2-[4-(5-methyl-2-quinolin-2-yl-1H-indol-3-yl)butanoylamino]benzoate Openeye Name: methyl 2-[4-[5-methyl-2-(2-quinolyl)-1H-indol-3-yl]butanoylamino]benzoate CAS Name: 2-[[4-[5-methyl-2-(2-quinolinyl)-1H-indol-3-yl]-1-oxobutyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[4-(5-methyl-2-quinolin-2-yl-1H-indol-3-yl)butanoylamino]benzoate Traditional Name: 2-[4-[5-methyl-2-(2-quinolyl)-1H-indol-3-yl]butanoylamino]benzoic acid methyl ester Formula: C30H27N3O3 MolecularWeight: 477.55368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2CCCC(=O)NC3=CC=CC=C3C(=O)OC)C4=NC5=CC=CC=C5C=C4

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2CCCC(=O)NC3=CC=CC=C3C(=O)OC)C4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C30H27N3O3/c1-19-14-16-26-23(18-19)21(29(33-26)27-17-15-20-8-3-5-11-24(20)31-27)10-7-13-28(34)32-25-12-6-4-9-22(25)30(35)36-2/h3-6,8-9,11-12,14-18,33H,7,10,13H2,1-2H3,(H,32,34)