4-[1-(5,5-dimethyl-8-oxidanylidene-6,7-dihydronaphthalen-2-yl)ethyl]benzoic acid

Systemtic Name: 4-[1-(5,5-dimethyl-8-oxidanylidene-6,7-dihydronaphthalen-2-yl)ethyl]benzoic acid Openeye Name: 4-[1-(1,1-dimethyl-4-oxo-tetralin-6-yl)ethyl]benzoic acid CAS Name: 4-[1-(5,5-dimethyl-8-oxo-6,7-dihydronaphthalen-2-yl)ethyl]benzoic acid IUPAC Name: 4-[1-(5,5-dimethyl-8-oxo-6,7-dihydronaphthalen-2-yl)ethyl]benzoic acid Traditional Name: 4-[1-(4-keto-1,1-dimethyl-tetralin-6-yl)ethyl]benzoic acid Formula: C21H22O3 MolecularWeight: 322.39758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C(=O)O)C2=CC3=C(C=C2)C(CCC3=O)(C)C

Isomeric SMILES

CC(C1=CC=C(C=C1)C(=O)O)C2=CC3=C(C=C2)C(CCC3=O)(C)C

InChI

InChI=1S/C21H22O3/c1-13(14-4-6-15(7-5-14)20(23)24)16-8-9-18-17(12-16)19(22)10-11-21(18,2)3/h4-9,12-13H,10-11H2,1-3H3,(H,23,24)