[6-[4-(3-propanoyloxybutyl)phenyl]pyridin-3-yl] (E)-oct-6-enoate

Systemtic Name: [6-[4-(3-propanoyloxybutyl)phenyl]pyridin-3-yl] (E)-oct-6-enoate Openeye Name: [6-[4-(3-propanoyloxybutyl)phenyl]-3-pyridyl] (E)-oct-6-enoate CAS Name: (E)-6-octenoic acid [6-[4-[3-(1-oxopropoxy)butyl]phenyl]-3-pyridinyl] ester IUPAC Name: [6-[4-(3-propanoyloxybutyl)phenyl]pyridin-3-yl] (E)-oct-6-enoate Traditional Name: (E)-oct-6-enoic acid [6-[4-(3-propionyloxybutyl)phenyl]-3-pyridyl] ester Formula: C26H33NO4 MolecularWeight: 423.54452

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC(C)CCC1=CC=C(C=C1)C2=NC=C(C=C2)OC(=O)CCCCC=CC

Isomeric SMILES

CCC(=O)OC(C)CCC1=CC=C(C=C1)C2=NC=C(C=C2)OC(=O)CCCC/C=C/C

InChI

InChI=1S/C26H33NO4/c1-4-6-7-8-9-10-26(29)31-23-17-18-24(27-19-23)22-15-13-21(14-16-22)12-11-20(3)30-25(28)5-2/h4,6,13-20H,5,7-12H2,1-3H3/b6-4+