ethyl 4-(1H-imidazo[4,5-b]pyridin-2-yl)-4-oxidanyl-azepane-1-carboxylate

Systemtic Name: ethyl 4-(1H-imidazo[4,5-b]pyridin-2-yl)-4-oxidanyl-azepane-1-carboxylate Openeye Name: ethyl 4-hydroxy-4-(1H-imidazo[4,5-b]pyridin-2-yl)azepane-1-carboxylate CAS Name: 4-hydroxy-4-(1H-imidazo[4,5-b]pyridin-2-yl)-1-azepanecarboxylic acid ethyl ester IUPAC Name: ethyl 4-hydroxy-4-(1H-imidazo[4,5-b]pyridin-2-yl)azepane-1-carboxylate Traditional Name: 4-hydroxy-4-(1H-imidazo[4,5-b]pyridin-2-yl)azepane-1-carboxylic acid ethyl ester Formula: C15H20N4O3 MolecularWeight: 304.3443

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCCC(CC1)(C2=NC3=C(N2)C=CC=N3)O

Isomeric SMILES

CCOC(=O)N1CCCC(CC1)(C2=NC3=C(N2)C=CC=N3)O

InChI

InChI=1S/C15H20N4O3/c1-2-22-14(20)19-9-4-6-15(21,7-10-19)13-17-11-5-3-8-16-12(11)18-13/h3,5,8,21H,2,4,6-7,9-10H2,1H3,(H,16,17,18)