ethyl 5-(azepan-1-ylcarbonylamino)-2,6-dimethyl-pyridine-3-carboxylate

Systemtic Name: ethyl 5-(azepan-1-ylcarbonylamino)-2,6-dimethyl-pyridine-3-carboxylate Openeye Name: ethyl 5-(azepane-1-carbonylamino)-2,6-dimethyl-pyridine-3-carboxylate CAS Name: 5-[[1-azepanyl(oxo)methyl]amino]-2,6-dimethyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(azepane-1-carbonylamino)-2,6-dimethylpyridine-3-carboxylate Traditional Name: 5-(azepane-1-carbonylamino)-2,6-dimethyl-nicotinic acid ethyl ester Formula: C17H25N3O3 MolecularWeight: 319.3987

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(N=C1C)C)NC(=O)N2CCCCCC2

Isomeric SMILES

CCOC(=O)C1=CC(=C(N=C1C)C)NC(=O)N2CCCCCC2

InChI

InChI=1S/C17H25N3O3/c1-4-23-16(21)14-11-15(13(3)18-12(14)2)19-17(22)20-9-7-5-6-8-10-20/h11H,4-10H2,1-3H3,(H,19,22)