2-oxidanyl-6-pyridin-3-yl-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]pyran-4-one

Systemtic Name: 2-oxidanyl-6-pyridin-3-yl-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]pyran-4-one Openeye Name: 2-hydroxy-6-(3-pyridyl)-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]pyran-4-one CAS Name: 2-hydroxy-6-(3-pyridinyl)-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]-4-pyranone IUPAC Name: 2-hydroxy-6-pyridin-3-yl-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]pyran-4-one Traditional Name: 2-hydroxy-6-(3-pyridyl)-3-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]pyran-4-one Formula: C25H31NO3 MolecularWeight: 393.51854

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCCC(=CCC1=C(OC(=CC1=O)C2=CN=CC=C2)O)C)C)C

Isomeric SMILES

CC(=CCC/C(=C/CC/C(=C/CC1=C(OC(=CC1=O)C2=CN=CC=C2)O)/C)/C)C

InChI

InChI=1S/C25H31NO3/c1-18(2)8-5-9-19(3)10-6-11-20(4)13-14-22-23(27)16-24(29-25(22)28)21-12-7-15-26-17-21/h7-8,10,12-13,15-17,28H,5-6,9,11,14H2,1-4H3/b19-10+,20-13+