4-(5,5,8,8-tetramethyl-3-oxidanylidene-6,7-dihydro-1H-benzo[f]isoindol-2-yl)benzoic acid

Systemtic Name: 4-(5,5,8,8-tetramethyl-3-oxidanylidene-6,7-dihydro-1H-benzo[f]isoindol-2-yl)benzoic acid Openeye Name: 4-(5,5,8,8-tetramethyl-3-oxo-6,7-dihydro-1H-benzo[f]isoindol-2-yl)benzoic acid CAS Name: 4-(5,5,8,8-tetramethyl-3-oxo-6,7-dihydro-1H-benzo[f]isoindol-2-yl)benzoic acid IUPAC Name: 4-(5,5,8,8-tetramethyl-3-oxo-6,7-dihydro-1H-benzo[f]isoindol-2-yl)benzoic acid Traditional Name: 4-(3-keto-5,5,8,8-tetramethyl-6,7-dihydro-1H-benz[f]isoindol-2-yl)benzoic acid Formula: C23H25NO3 MolecularWeight: 363.4495

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=C1C=C3CN(C(=O)C3=C2)C4=CC=C(C=C4)C(=O)O)(C)C)C

Isomeric SMILES

CC1(CCC(C2=C1C=C3CN(C(=O)C3=C2)C4=CC=C(C=C4)C(=O)O)(C)C)C

InChI

InChI=1S/C23H25NO3/c1-22(2)9-10-23(3,4)19-12-17-15(11-18(19)22)13-24(20(17)25)16-7-5-14(6-8-16)21(26)27/h5-8,11-12H,9-10,13H2,1-4H3,(H,26,27)