[2-[4-(5-acetyloxyhexyl)phenyl]pyrimidin-5-yl] (E)-undec-2-enoate

Systemtic Name: [2-[4-(5-acetyloxyhexyl)phenyl]pyrimidin-5-yl] (E)-undec-2-enoate Openeye Name: [2-[4-(5-acetoxyhexyl)phenyl]pyrimidin-5-yl] (E)-undec-2-enoate CAS Name: (E)-2-undecenoic acid [2-[4-(5-acetyloxyhexyl)phenyl]-5-pyrimidinyl] ester IUPAC Name: [2-[4-(5-acetyloxyhexyl)phenyl]pyrimidin-5-yl] (E)-undec-2-enoate Traditional Name: (E)-undec-2-enoic acid [2-[4-(5-acetoxyhexyl)phenyl]pyrimidin-5-yl] ester Formula: C29H40N2O4 MolecularWeight: 480.6389

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H40N2O4/c1-4-5-6-7-8-9-10-11-16-28(33)35-27-21-30-29(31-22-27)26-19-17-25(18-20-26)15-13-12-14-23(2)34-24(3)32/h11,16-23H,4-10,12-15H2,1-3H3/b16-11+