[2-(azepan-1-yl)-2-oxidanylidene-ethyl] 7-methylimidazo[1,2-a]pyridine-2-carboxylate

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl] 7-methylimidazo[1,2-a]pyridine-2-carboxylate Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl] 7-methylimidazo[1,2-a]pyridine-2-carboxylate CAS Name: 7-methyl-2-imidazo[1,2-a]pyridinecarboxylic acid [2-(1-azepanyl)-2-oxoethyl] ester IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl] 7-methylimidazo[1,2-a]pyridine-2-carboxylate Traditional Name: 7-methylimidazo[1,2-a]pyridine-2-carboxylic acid [2-(azepan-1-yl)-2-keto-ethyl] ester Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=CN2C=C1)C(=O)OCC(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC2=NC(=CN2C=C1)C(=O)OCC(=O)N3CCCCCC3

InChI

InChI=1S/C17H21N3O3/c1-13-6-9-20-11-14(18-15(20)10-13)17(22)23-12-16(21)19-7-4-2-3-5-8-19/h6,9-11H,2-5,7-8,12H2,1H3