methyl 5-cyano-1-[2-(cyclooctylamino)-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: methyl 5-cyano-1-[2-(cyclooctylamino)-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridine-3-carboxylate Openeye Name: methyl 5-cyano-1-[2-(cyclooctylamino)-2-oxo-ethyl]-6-oxo-pyridine-3-carboxylate CAS Name: 5-cyano-1-[2-(cyclooctylamino)-2-oxoethyl]-6-oxo-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-cyano-1-[2-(cyclooctylamino)-2-oxoethyl]-6-oxopyridine-3-carboxylate Traditional Name: 5-cyano-1-[2-(cyclooctylamino)-2-keto-ethyl]-6-keto-nicotinic acid methyl ester Formula: C18H23N3O4 MolecularWeight: 345.39292

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C(=O)C(=C1)C#N)CC(=O)NC2CCCCCCC2

Isomeric SMILES

COC(=O)C1=CN(C(=O)C(=C1)C#N)CC(=O)NC2CCCCCCC2

InChI

InChI=1S/C18H23N3O4/c1-25-18(24)14-9-13(10-19)17(23)21(11-14)12-16(22)20-15-7-5-3-2-4-6-8-15/h9,11,15H,2-8,12H2,1H3,(H,20,22)