(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 4-tert-butylcyclohexane-1-carboxylate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 4-tert-butylcyclohexane-1-carboxylate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 4-tert-butylcyclohexanecarboxylate CAS Name: 4-tert-butyl-1-cyclohexanecarboxylic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 4-tert-butylcyclohexane-1-carboxylate Traditional Name: 4-tert-butylcyclohexanecarboxylic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C23H30O4 MolecularWeight: 370.4819

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3CCC(CC3)C(C)(C)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3CCC(CC3)C(C)(C)C)C

InChI

InChI=1S/C23H30O4/c1-14-10-19-17(12-21(24)27-20(19)11-15(14)2)13-26-22(25)16-6-8-18(9-7-16)23(3,4)5/h10-12,16,18H,6-9,13H2,1-5H3