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

Systemtic Name: [2-[4-(5-propanoyloxyhexyl)phenyl]pyrimidin-5-yl] (E)-undec-2-enoate Openeye Name: [2-[4-(5-propanoyloxyhexyl)phenyl]pyrimidin-5-yl] (E)-undec-2-enoate CAS Name: (E)-2-undecenoic acid [2-[4-[5-(1-oxopropoxy)hexyl]phenyl]-5-pyrimidinyl] ester IUPAC Name: [2-[4-(5-propanoyloxyhexyl)phenyl]pyrimidin-5-yl] (E)-undec-2-enoate Traditional Name: (E)-undec-2-enoic acid [2-[4-(5-propionyloxyhexyl)phenyl]pyrimidin-5-yl] ester Formula: C30H42N2O4 MolecularWeight: 494.66548

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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)CC

Isomeric SMILES

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

InChI

InChI=1S/C30H42N2O4/c1-4-6-7-8-9-10-11-12-17-29(34)36-27-22-31-30(32-23-27)26-20-18-25(19-21-26)16-14-13-15-24(3)35-28(33)5-2/h12,17-24H,4-11,13-16H2,1-3H3/b17-12+