[2-[4-(3-propanoyloxybutyl)phenyl]pyrimidin-5-yl] dec-9-enoate

Systemtic Name: [2-[4-(3-propanoyloxybutyl)phenyl]pyrimidin-5-yl] dec-9-enoate Openeye Name: [2-[4-(3-propanoyloxybutyl)phenyl]pyrimidin-5-yl] dec-9-enoate CAS Name: 9-decenoic acid [2-[4-[3-(1-oxopropoxy)butyl]phenyl]-5-pyrimidinyl] ester IUPAC Name: [2-[4-(3-propanoyloxybutyl)phenyl]pyrimidin-5-yl] dec-9-enoate Traditional Name: dec-9-enoic acid [2-[4-(3-propionyloxybutyl)phenyl]pyrimidin-5-yl] ester Formula: C27H36N2O4 MolecularWeight: 452.58574

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC(C)CCC1=CC=C(C=C1)C2=NC=C(C=N2)OC(=O)CCCCCCCC=C

Isomeric SMILES

CCC(=O)OC(C)CCC1=CC=C(C=C1)C2=NC=C(C=N2)OC(=O)CCCCCCCC=C

InChI

InChI=1S/C27H36N2O4/c1-4-6-7-8-9-10-11-12-26(31)33-24-19-28-27(29-20-24)23-17-15-22(16-18-23)14-13-21(3)32-25(30)5-2/h4,15-21H,1,5-14H2,2-3H3