ethyl (E)-7-(oxan-2-yloxy)-3-(3-pyridin-3-ylpropyl)hept-2-enoate

Systemtic Name: ethyl (E)-7-(oxan-2-yloxy)-3-(3-pyridin-3-ylpropyl)hept-2-enoate Openeye Name: ethyl (E)-3-[3-(3-pyridyl)propyl]-7-tetrahydropyran-2-yloxy-hept-2-enoate CAS Name: (E)-7-(2-oxanyloxy)-3-[3-(3-pyridinyl)propyl]-2-heptenoic acid ethyl ester IUPAC Name: ethyl (E)-7-(oxan-2-yloxy)-3-(3-pyridin-3-ylpropyl)hept-2-enoate Traditional Name: (E)-3-[3-(3-pyridyl)propyl]-7-tetrahydropyran-2-yloxy-hept-2-enoic acid ethyl ester Formula: C22H33NO4 MolecularWeight: 375.50172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(CCCCOC1CCCCO1)CCCC2=CN=CC=C2

Isomeric SMILES

CCOC(=O)/C=C(/CCCCOC1CCCCO1)\CCCC2=CN=CC=C2

InChI

InChI=1S/C22H33NO4/c1-2-25-21(24)17-19(10-7-11-20-12-8-14-23-18-20)9-3-5-15-26-22-13-4-6-16-27-22/h8,12,14,17-18,22H,2-7,9-11,13,15-16H2,1H3/b19-17-