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

Systemtic Name: methyl 2-[4-(2-pyridin-2-yl-1H-indol-3-yl)butanoylamino]benzoate Openeye Name: methyl 2-[4-[2-(2-pyridyl)-1H-indol-3-yl]butanoylamino]benzoate CAS Name: 2-[[1-oxo-4-[2-(2-pyridinyl)-1H-indol-3-yl]butyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[4-(2-pyridin-2-yl-1H-indol-3-yl)butanoylamino]benzoate Traditional Name: 2-[4-[2-(2-pyridyl)-1H-indol-3-yl]butanoylamino]benzoic acid methyl ester Formula: C25H23N3O3 MolecularWeight: 413.46842

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CCCC2=C(NC3=CC=CC=C32)C4=CC=CC=N4

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CCCC2=C(NC3=CC=CC=C32)C4=CC=CC=N4

InChI

InChI=1S/C25H23N3O3/c1-31-25(30)19-10-3-5-13-21(19)27-23(29)15-8-11-18-17-9-2-4-12-20(17)28-24(18)22-14-6-7-16-26-22/h2-7,9-10,12-14,16,28H,8,11,15H2,1H3,(H,27,29)