[6-[4-(5-propoxypentyl)phenyl]pyridin-3-yl] (E)-dodec-2-enoate

Systemtic Name: [6-[4-(5-propoxypentyl)phenyl]pyridin-3-yl] (E)-dodec-2-enoate Openeye Name: [6-[4-(5-propoxypentyl)phenyl]-3-pyridyl] (E)-dodec-2-enoate CAS Name: (E)-2-dodecenoic acid [6-[4-(5-propoxypentyl)phenyl]-3-pyridinyl] ester IUPAC Name: [6-[4-(5-propoxypentyl)phenyl]pyridin-3-yl] (E)-dodec-2-enoate Traditional Name: (E)-dodec-2-enoic acid [6-[4-(5-propoxypentyl)phenyl]-3-pyridyl] ester Formula: C31H45NO3 MolecularWeight: 479.6939

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC=CC(=O)OC1=CN=C(C=C1)C2=CC=C(C=C2)CCCCCOCCC

Isomeric SMILES

CCCCCCCCC/C=C/C(=O)OC1=CN=C(C=C1)C2=CC=C(C=C2)CCCCCOCCC

InChI

InChI=1S/C31H45NO3/c1-3-5-6-7-8-9-10-11-14-17-31(33)35-29-22-23-30(32-26-29)28-20-18-27(19-21-28)16-13-12-15-25-34-24-4-2/h14,17-23,26H,3-13,15-16,24-25H2,1-2H3/b17-14+