methyl 4-[(5,5,8,8-tetramethyl-1-oxidanylidene-3,4,6,7-tetrahydro-2H-anthracen-2-yl)carbonyl]benzoate

Systemtic Name: methyl 4-[(5,5,8,8-tetramethyl-1-oxidanylidene-3,4,6,7-tetrahydro-2H-anthracen-2-yl)carbonyl]benzoate Openeye Name: methyl 4-(5,5,8,8-tetramethyl-1-oxo-3,4,6,7-tetrahydro-2H-anthracene-2-carbonyl)benzoate CAS Name: 4-[oxo-(5,5,8,8-tetramethyl-1-oxo-3,4,6,7-tetrahydro-2H-anthracen-2-yl)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-(5,5,8,8-tetramethyl-1-oxo-3,4,6,7-tetrahydro-2H-anthracene-2-carbonyl)benzoate Traditional Name: 4-(1-keto-5,5,8,8-tetramethyl-3,4,6,7-tetrahydro-2H-anthracene-2-carbonyl)benzoic acid methyl ester Formula: C27H30O4 MolecularWeight: 418.5247

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=C1C=C3CCC(C(=O)C3=C2)C(=O)C4=CC=C(C=C4)C(=O)OC)(C)C)C

Isomeric SMILES

CC1(CCC(C2=C1C=C3CCC(C(=O)C3=C2)C(=O)C4=CC=C(C=C4)C(=O)OC)(C)C)C

InChI

InChI=1S/C27H30O4/c1-26(2)12-13-27(3,4)22-15-20-18(14-21(22)26)10-11-19(24(20)29)23(28)16-6-8-17(9-7-16)25(30)31-5/h6-9,14-15,19H,10-13H2,1-5H3