(2-oxidanylideneazepan-3-yl) 2-ethoxypyridine-3-carboxylate

Systemtic Name: (2-oxidanylideneazepan-3-yl) 2-ethoxypyridine-3-carboxylate Openeye Name: (2-oxoazepan-3-yl) 2-ethoxypyridine-3-carboxylate CAS Name: 2-ethoxy-3-pyridinecarboxylic acid (2-oxo-3-azepanyl) ester IUPAC Name: (2-oxoazepan-3-yl) 2-ethoxypyridine-3-carboxylate Traditional Name: 2-ethoxynicotinic acid (2-ketoazepan-3-yl) ester Formula: C14H18N2O4 MolecularWeight: 278.30372

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)C(=O)OC2CCCCNC2=O

Isomeric SMILES

CCOC1=C(C=CC=N1)C(=O)OC2CCCCNC2=O

InChI

InChI=1S/C14H18N2O4/c1-2-19-13-10(6-5-9-16-13)14(18)20-11-7-3-4-8-15-12(11)17/h5-6,9,11H,2-4,7-8H2,1H3,(H,15,17)