ethanedioic acid; ethyl 4-(5-cyano-3,6-dihydro-2H-pyridin-1-yl)butanoate

Systemtic Name: ethanedioic acid; ethyl 4-(5-cyano-3,6-dihydro-2H-pyridin-1-yl)butanoate Openeye Name: ethyl 4-(5-cyano-3,6-dihydro-2H-pyridin-1-yl)butanoate; oxalic acid CAS Name: 4-(5-cyano-3,6-dihydro-2H-pyridin-1-yl)butanoic acid ethyl ester; oxalic acid IUPAC Name: ethyl 4-(5-cyano-3,6-dihydro-2H-pyridin-1-yl)butanoate; oxalic acid Traditional Name: 4-(5-cyano-3,6-dihydro-2H-pyridin-1-yl)butyric acid ethyl ester; oxalic acid Formula: C14H20N2O6 MolecularWeight: 312.3184

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1CCC=C(C1)C#N.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC(=O)CCCN1CCC=C(C1)C#N.C(=O)(C(=O)O)O

InChI

InChI=1S/C12H18N2O2.C2H2O4/c1-2-16-12(15)6-4-8-14-7-3-5-11(9-13)10-14;3-1(4)2(5)6/h5H,2-4,6-8,10H2,1H3;(H,3,4)(H,5,6)