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

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

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

Isomeric SMILES

CCCCC/C=C/CCCCC(=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/h8-9,18-23,26H,3-7,10-17,24-25H2,1-2H3/b9-8+