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

Systemtic Name: methyl 2-[methyl-[4-(2-pyridin-2-yl-1H-indol-3-yl)butanoyl]amino]benzoate Openeye Name: methyl 2-[methyl-[4-[2-(2-pyridyl)-1H-indol-3-yl]butanoyl]amino]benzoate CAS Name: 2-[methyl-[1-oxo-4-[2-(2-pyridinyl)-1H-indol-3-yl]butyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[methyl-[4-(2-pyridin-2-yl-1H-indol-3-yl)butanoyl]amino]benzoate Traditional Name: 2-[methyl-[4-[2-(2-pyridyl)-1H-indol-3-yl]butanoyl]amino]benzoic acid methyl ester Formula: C26H25N3O3 MolecularWeight: 427.495

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)OC)C(=O)CCCC2=C(NC3=CC=CC=C32)C4=CC=CC=N4

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)OC)C(=O)CCCC2=C(NC3=CC=CC=C32)C4=CC=CC=N4

InChI

InChI=1S/C26H25N3O3/c1-29(23-15-6-4-11-20(23)26(31)32-2)24(30)16-9-12-19-18-10-3-5-13-21(18)28-25(19)22-14-7-8-17-27-22/h3-8,10-11,13-15,17,28H,9,12,16H2,1-2H3