8-bromanyl-2-methyl-6-oxidanyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trienyl]-3H-chromen-4-one

Systemtic Name: 8-bromanyl-2-methyl-6-oxidanyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trienyl]-3H-chromen-4-one Openeye Name: 8-bromo-6-hydroxy-2-methyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trienyl]chroman-4-one CAS Name: 8-bromo-6-hydroxy-2-methyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trienyl]-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 8-bromo-6-hydroxy-2-methyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trienyl]-3H-chromen-4-one Traditional Name: 8-bromo-6-hydroxy-2-methyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trienyl]chroman-4-one Formula: C26H35BrO3 MolecularWeight: 475.4583

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCCC(=CCCC1(CC(=O)C2=CC(=CC(=C2O1)Br)O)C)C)C)C

Isomeric SMILES

CC(=CCC/C(=C/CC/C(=C/CCC1(CC(=O)C2=CC(=CC(=C2O1)Br)O)C)/C)/C)C

InChI

InChI=1S/C26H35BrO3/c1-18(2)9-6-10-19(3)11-7-12-20(4)13-8-14-26(5)17-24(29)22-15-21(28)16-23(27)25(22)30-26/h9,11,13,15-16,28H,6-8,10,12,14,17H2,1-5H3/b19-11+,20-13+