6,6-dimethyl-3-(3-methyloctan-2-yl)-1-oxidanyl-7,8,9,10-tetrahydrobenzo[c]chromene-9-carboxylic acid

Systemtic Name: 6,6-dimethyl-3-(3-methyloctan-2-yl)-1-oxidanyl-7,8,9,10-tetrahydrobenzo[c]chromene-9-carboxylic acid Openeye Name: 3-(1,2-dimethylheptyl)-1-hydroxy-6,6-dimethyl-7,8,9,10-tetrahydrobenzo[c]chromene-9-carboxylic acid CAS Name: 1-hydroxy-6,6-dimethyl-3-(3-methyloctan-2-yl)-7,8,9,10-tetrahydrobenzo[c][1]benzopyran-9-carboxylic acid IUPAC Name: 1-hydroxy-6,6-dimethyl-3-(3-methyloctan-2-yl)-7,8,9,10-tetrahydrobenzo[c]chromene-9-carboxylic acid Traditional Name: 3-(1,2-dimethylheptyl)-1-hydroxy-6,6-dimethyl-7,8,9,10-tetrahydrobenzo[c]chromene-9-carboxylic acid Formula: C25H36O4 MolecularWeight: 400.55094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)C(C)C1=CC2=C(C3=C(CCC(C3)C(=O)O)C(O2)(C)C)C(=C1)O

Isomeric SMILES

CCCCCC(C)C(C)C1=CC2=C(C3=C(CCC(C3)C(=O)O)C(O2)(C)C)C(=C1)O

InChI

InChI=1S/C25H36O4/c1-6-7-8-9-15(2)16(3)18-13-21(26)23-19-12-17(24(27)28)10-11-20(19)25(4,5)29-22(23)14-18/h13-17,26H,6-12H2,1-5H3,(H,27,28)