4-oxidanylidene-2-[2-(2,6,6-trimethylcyclohexen-1-yl)ethyl]chromene-3-carboxylic acid

Systemtic Name: 4-oxidanylidene-2-[2-(2,6,6-trimethylcyclohexen-1-yl)ethyl]chromene-3-carboxylic acid Openeye Name: 4-oxo-2-[2-(2,6,6-trimethylcyclohexen-1-yl)ethyl]chromene-3-carboxylic acid CAS Name: 4-oxo-2-[2-(2,6,6-trimethyl-1-cyclohexenyl)ethyl]-1-benzopyran-3-carboxylic acid IUPAC Name: 4-oxo-2-[2-(2,6,6-trimethylcyclohexen-1-yl)ethyl]chromene-3-carboxylic acid Traditional Name: 4-keto-2-[2-(2,6,6-trimethylcyclohexen-1-yl)ethyl]chromene-3-carboxylic acid Formula: C21H24O4 MolecularWeight: 340.41286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1)(C)C)CCC2=C(C(=O)C3=CC=CC=C3O2)C(=O)O

Isomeric SMILES

CC1=C(C(CCC1)(C)C)CCC2=C(C(=O)C3=CC=CC=C3O2)C(=O)O

InChI

InChI=1S/C21H24O4/c1-13-7-6-12-21(2,3)15(13)10-11-17-18(20(23)24)19(22)14-8-4-5-9-16(14)25-17/h4-5,8-9H,6-7,10-12H2,1-3H3,(H,23,24)