methyl 3-(2-methyloctan-2-yl)-1-oxidanyl-6-oxidanylidene-benzo[c]chromene-9-carboxylate

Systemtic Name: methyl 3-(2-methyloctan-2-yl)-1-oxidanyl-6-oxidanylidene-benzo[c]chromene-9-carboxylate Openeye Name: methyl 3-(1,1-dimethylheptyl)-1-hydroxy-6-oxo-benzo[c]chromene-9-carboxylate CAS Name: 1-hydroxy-3-(2-methyloctan-2-yl)-6-oxo-9-benzo[c][1]benzopyrancarboxylic acid methyl ester IUPAC Name: methyl 1-hydroxy-3-(2-methyloctan-2-yl)-6-oxobenzo[c]chromene-9-carboxylate Traditional Name: 3-(1,1-dimethylheptyl)-1-hydroxy-6-keto-benzo[c]chromene-9-carboxylic acid methyl ester Formula: C24H28O5 MolecularWeight: 396.47612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC2=C(C(=C1)O)C3=C(C=CC(=C3)C(=O)OC)C(=O)O2

Isomeric SMILES

CCCCCCC(C)(C)C1=CC2=C(C(=C1)O)C3=C(C=CC(=C3)C(=O)OC)C(=O)O2

InChI

InChI=1S/C24H28O5/c1-5-6-7-8-11-24(2,3)16-13-19(25)21-18-12-15(22(26)28-4)9-10-17(18)23(27)29-20(21)14-16/h9-10,12-14,25H,5-8,11H2,1-4H3