ethyl (E)-7-[4-[2-(1,3-dioxolan-2-yl)ethoxy]phenyl]-7-pyridin-3-yl-hept-6-enoate

Systemtic Name: ethyl (E)-7-[4-[2-(1,3-dioxolan-2-yl)ethoxy]phenyl]-7-pyridin-3-yl-hept-6-enoate Openeye Name: ethyl (E)-7-[4-[2-(1,3-dioxolan-2-yl)ethoxy]phenyl]-7-(3-pyridyl)hept-6-enoate CAS Name: (E)-7-[4-[2-(1,3-dioxolan-2-yl)ethoxy]phenyl]-7-(3-pyridinyl)-6-heptenoic acid ethyl ester IUPAC Name: ethyl (E)-7-[4-[2-(1,3-dioxolan-2-yl)ethoxy]phenyl]-7-pyridin-3-ylhept-6-enoate Traditional Name: (E)-7-[4-[2-(1,3-dioxolan-2-yl)ethoxy]phenyl]-7-(3-pyridyl)hept-6-enoic acid ethyl ester Formula: C25H31NO5 MolecularWeight: 425.51734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCC=C(C1=CC=C(C=C1)OCCC2OCCO2)C3=CN=CC=C3

Isomeric SMILES

CCOC(=O)CCCC/C=C(\C1=CC=C(C=C1)OCCC2OCCO2)/C3=CN=CC=C3

InChI

InChI=1S/C25H31NO5/c1-2-28-24(27)9-5-3-4-8-23(21-7-6-15-26-19-21)20-10-12-22(13-11-20)29-16-14-25-30-17-18-31-25/h6-8,10-13,15,19,25H,2-5,9,14,16-18H2,1H3/b23-8+