[2-(azepan-1-yl)-2-oxidanylidene-ethyl] 2-oxidanylidene-1H-pyridine-3-carboxylate

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl] 2-oxidanylidene-1H-pyridine-3-carboxylate Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl] 2-oxo-1H-pyridine-3-carboxylate CAS Name: 2-oxo-1H-pyridine-3-carboxylic acid [2-(1-azepanyl)-2-oxoethyl] ester IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl] 2-oxo-1H-pyridine-3-carboxylate Traditional Name: 2-keto-1H-pyridine-3-carboxylic acid [2-(azepan-1-yl)-2-keto-ethyl] ester Formula: C14H18N2O4 MolecularWeight: 278.30372

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)COC(=O)C2=CC=CNC2=O

Isomeric SMILES

C1CCCN(CC1)C(=O)COC(=O)C2=CC=CNC2=O

InChI

InChI=1S/C14H18N2O4/c17-12(16-8-3-1-2-4-9-16)10-20-14(19)11-6-5-7-15-13(11)18/h5-7H,1-4,8-10H2,(H,15,18)