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

Systemtic Name: methyl 6,6-dimethyl-3-(2-methyloctan-2-yl)-1-oxidanyl-benzo[c]chromene-9-carboxylate Openeye Name: methyl 3-(1,1-dimethylheptyl)-1-hydroxy-6,6-dimethyl-benzo[c]chromene-9-carboxylate CAS Name: 1-hydroxy-6,6-dimethyl-3-(2-methyloctan-2-yl)-9-benzo[c][1]benzopyrancarboxylic acid methyl ester IUPAC Name: methyl 1-hydroxy-6,6-dimethyl-3-(2-methyloctan-2-yl)benzo[c]chromene-9-carboxylate Traditional Name: 3-(1,1-dimethylheptyl)-1-hydroxy-6,6-dimethyl-benzo[c]chromene-9-carboxylic acid methyl ester Formula: C26H34O4 MolecularWeight: 410.54576

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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(O2)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C26H34O4/c1-7-8-9-10-13-25(2,3)18-15-21(27)23-19-14-17(24(28)29-6)11-12-20(19)26(4,5)30-22(23)16-18/h11-12,14-16,27H,7-10,13H2,1-6H3