methyl 5-(2-cyanoethyl)-7-pyridin-3-yl-heptanoate

Systemtic Name: methyl 5-(2-cyanoethyl)-7-pyridin-3-yl-heptanoate Openeye Name: methyl 5-(2-cyanoethyl)-7-(3-pyridyl)heptanoate CAS Name: 5-(2-cyanoethyl)-7-(3-pyridinyl)heptanoic acid methyl ester IUPAC Name: methyl 5-(2-cyanoethyl)-7-pyridin-3-ylheptanoate Traditional Name: 5-(2-cyanoethyl)-7-(3-pyridyl)enanthic acid methyl ester Formula: C16H22N2O2 MolecularWeight: 274.35808

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC(CCC#N)CCC1=CN=CC=C1

Isomeric SMILES

COC(=O)CCCC(CCC#N)CCC1=CN=CC=C1

InChI

InChI=1S/C16H22N2O2/c1-20-16(19)8-2-5-14(6-3-11-17)9-10-15-7-4-12-18-13-15/h4,7,12-14H,2-3,5-6,8-10H2,1H3