6,6-dimethyl-1-oxidanyl-3-(4-oxidanylpentyl)benzo[c]chromene-9-carboxylic acid

Systemtic Name: 6,6-dimethyl-1-oxidanyl-3-(4-oxidanylpentyl)benzo[c]chromene-9-carboxylic acid Openeye Name: 1-hydroxy-3-(4-hydroxypentyl)-6,6-dimethyl-benzo[c]chromene-9-carboxylic acid CAS Name: 1-hydroxy-3-(4-hydroxypentyl)-6,6-dimethyl-9-benzo[c][1]benzopyrancarboxylic acid IUPAC Name: 1-hydroxy-3-(4-hydroxypentyl)-6,6-dimethylbenzo[c]chromene-9-carboxylic acid Traditional Name: 1-hydroxy-3-(4-hydroxypentyl)-6,6-dimethyl-benzo[c]chromene-9-carboxylic acid Formula: C21H24O5 MolecularWeight: 356.41226

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC1=CC2=C(C(=C1)O)C3=C(C=CC(=C3)C(=O)O)C(O2)(C)C)O

Isomeric SMILES

CC(CCCC1=CC2=C(C(=C1)O)C3=C(C=CC(=C3)C(=O)O)C(O2)(C)C)O

InChI

InChI=1S/C21H24O5/c1-12(22)5-4-6-13-9-17(23)19-15-11-14(20(24)25)7-8-16(15)21(2,3)26-18(19)10-13/h7-12,22-23H,4-6H2,1-3H3,(H,24,25)