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

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl adamantane-1-carboxylate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C23H26O4 MolecularWeight: 366.45014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C34CC5CC(C3)CC(C5)C4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C34CC5CC(C3)CC(C5)C4)C

InChI

InChI=1S/C23H26O4/c1-13-3-19-18(8-21(24)27-20(19)4-14(13)2)12-26-22(25)23-9-15-5-16(10-23)7-17(6-15)11-23/h3-4,8,15-17H,5-7,9-12H2,1-2H3