tert-butyl 3-(6-azanyl-3-oxidanylidene-4H-quinoxalin-2-yl)pyrrolo[2,3-b]pyridine-1-carboxylate

Systemtic Name: tert-butyl 3-(6-azanyl-3-oxidanylidene-4H-quinoxalin-2-yl)pyrrolo[2,3-b]pyridine-1-carboxylate Openeye Name: tert-butyl 3-(6-amino-3-oxo-4H-quinoxalin-2-yl)pyrrolo[2,3-b]pyridine-1-carboxylate CAS Name: 3-(6-amino-3-oxo-4H-quinoxalin-2-yl)-1-pyrrolo[2,3-b]pyridinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(6-amino-3-oxo-4H-quinoxalin-2-yl)pyrrolo[2,3-b]pyridine-1-carboxylate Traditional Name: 3-(6-amino-3-keto-4H-quinoxalin-2-yl)pyrrolo[2,3-b]pyridine-1-carboxylic acid tert-butyl ester Formula: C20H19N5O3 MolecularWeight: 377.39656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=C1N=CC=C2)C3=NC4=C(C=C(C=C4)N)NC3=O

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=C1N=CC=C2)C3=NC4=C(C=C(C=C4)N)NC3=O

InChI

InChI=1S/C20H19N5O3/c1-20(2,3)28-19(27)25-10-13(12-5-4-8-22-17(12)25)16-18(26)24-15-9-11(21)6-7-14(15)23-16/h4-10H,21H2,1-3H3,(H,24,26)