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

Systemtic Name: methyl 4-[4-(2-pyridin-2-yl-1H-indol-3-yl)butanoylamino]benzoate Openeye Name: methyl 4-[4-[2-(2-pyridyl)-1H-indol-3-yl]butanoylamino]benzoate CAS Name: 4-[[1-oxo-4-[2-(2-pyridinyl)-1H-indol-3-yl]butyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[4-(2-pyridin-2-yl-1H-indol-3-yl)butanoylamino]benzoate Traditional Name: 4-[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=C(C=C1)NC(=O)CCCC2=C(NC3=CC=CC=C32)C4=CC=CC=N4

Isomeric SMILES

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

InChI

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