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

Systemtic Name: methyl 2-[4-(5-fluoranyl-2-quinolin-2-yl-1H-indol-3-yl)butanoylamino]benzoate Openeye Name: methyl 2-[4-[5-fluoro-2-(2-quinolyl)-1H-indol-3-yl]butanoylamino]benzoate CAS Name: 2-[[4-[5-fluoro-2-(2-quinolinyl)-1H-indol-3-yl]-1-oxobutyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[4-(5-fluoro-2-quinolin-2-yl-1H-indol-3-yl)butanoylamino]benzoate Traditional Name: 2-[4-[5-fluoro-2-(2-quinolyl)-1H-indol-3-yl]butanoylamino]benzoic acid methyl ester Formula: C29H24FN3O3 MolecularWeight: 481.517563

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CCCC2=C(NC3=C2C=C(C=C3)F)C4=NC5=CC=CC=C5C=C4

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CCCC2=C(NC3=C2C=C(C=C3)F)C4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C29H24FN3O3/c1-36-29(35)21-8-3-5-11-24(21)32-27(34)12-6-9-20-22-17-19(30)14-16-25(22)33-28(20)26-15-13-18-7-2-4-10-23(18)31-26/h2-5,7-8,10-11,13-17,33H,6,9,12H2,1H3,(H,32,34)