[2-[4-(5-propanoyloxyhexyl)phenyl]pyrimidin-5-yl] (E)-non-3-enoate

Systemtic Name: [2-[4-(5-propanoyloxyhexyl)phenyl]pyrimidin-5-yl] (E)-non-3-enoate Openeye Name: [2-[4-(5-propanoyloxyhexyl)phenyl]pyrimidin-5-yl] (E)-non-3-enoate CAS Name: (E)-3-nonenoic acid [2-[4-[5-(1-oxopropoxy)hexyl]phenyl]-5-pyrimidinyl] ester IUPAC Name: [2-[4-(5-propanoyloxyhexyl)phenyl]pyrimidin-5-yl] (E)-non-3-enoate Traditional Name: (E)-non-3-enoic acid [2-[4-(5-propionyloxyhexyl)phenyl]pyrimidin-5-yl] ester Formula: C28H38N2O4 MolecularWeight: 466.61232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC(=O)OC1=CN=C(N=C1)C2=CC=C(C=C2)CCCCC(C)OC(=O)CC

Isomeric SMILES

CCCCC/C=C/CC(=O)OC1=CN=C(N=C1)C2=CC=C(C=C2)CCCCC(C)OC(=O)CC

InChI

InChI=1S/C28H38N2O4/c1-4-6-7-8-9-10-15-27(32)34-25-20-29-28(30-21-25)24-18-16-23(17-19-24)14-12-11-13-22(3)33-26(31)5-2/h9-10,16-22H,4-8,11-15H2,1-3H3/b10-9+