tert-butyl 3-[[(8-oxidanyl-1,6-naphthyridin-7-yl)carbonylamino]methyl]indole-1-carboxylate

Systemtic Name: tert-butyl 3-[[(8-oxidanyl-1,6-naphthyridin-7-yl)carbonylamino]methyl]indole-1-carboxylate Openeye Name: tert-butyl 3-[[(8-hydroxy-1,6-naphthyridine-7-carbonyl)amino]methyl]indole-1-carboxylate CAS Name: 3-[[[(8-hydroxy-1,6-naphthyridin-7-yl)-oxomethyl]amino]methyl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[(8-hydroxy-1,6-naphthyridine-7-carbonyl)amino]methyl]indole-1-carboxylate Traditional Name: 3-[[(8-hydroxy-1,6-naphthyridine-7-carbonyl)amino]methyl]indole-1-carboxylic acid tert-butyl ester Formula: C23H22N4O4 MolecularWeight: 418.44518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)CNC(=O)C3=NC=C4C=CC=NC4=C3O

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)CNC(=O)C3=NC=C4C=CC=NC4=C3O

InChI

InChI=1S/C23H22N4O4/c1-23(2,3)31-22(30)27-13-15(16-8-4-5-9-17(16)27)12-26-21(29)19-20(28)18-14(11-25-19)7-6-10-24-18/h4-11,13,28H,12H2,1-3H3,(H,26,29)