9-(2-oxidanyl-4-oxidanylidene-chromen-7-yl)oxynonyl 4,6,6-trimethylheptanoate

Systemtic Name: 9-(2-oxidanyl-4-oxidanylidene-chromen-7-yl)oxynonyl 4,6,6-trimethylheptanoate Openeye Name: 9-(2-hydroxy-4-oxo-chromen-7-yl)oxynonyl 4,6,6-trimethylheptanoate CAS Name: 4,6,6-trimethylheptanoic acid 9-[(2-hydroxy-4-oxo-1-benzopyran-7-yl)oxy]nonyl ester IUPAC Name: 9-(2-hydroxy-4-oxochromen-7-yl)oxynonyl 4,6,6-trimethylheptanoate Traditional Name: 4,6,6-trimethylenanthic acid 9-(2-hydroxy-4-keto-chromen-7-yl)oxynonyl ester Formula: C28H42O6 MolecularWeight: 474.62948

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=O)OCCCCCCCCCOC1=CC2=C(C=C1)C(=O)C=C(O2)O)CC(C)(C)C

Isomeric SMILES

CC(CCC(=O)OCCCCCCCCCOC1=CC2=C(C=C1)C(=O)C=C(O2)O)CC(C)(C)C

InChI

InChI=1S/C28H42O6/c1-21(20-28(2,3)4)12-15-26(30)33-17-11-9-7-5-6-8-10-16-32-22-13-14-23-24(29)19-27(31)34-25(23)18-22/h13-14,18-19,21,31H,5-12,15-17,20H2,1-4H3