(4-methyl-2-oxidanylidene-chromen-7-yl) 3-chloranyladamantane-1-carboxylate

Systemtic Name: (4-methyl-2-oxidanylidene-chromen-7-yl) 3-chloranyladamantane-1-carboxylate Openeye Name: (4-methyl-2-oxo-chromen-7-yl) 3-chloroadamantane-1-carboxylate CAS Name: 3-chloro-1-adamantanecarboxylic acid (4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-methyl-2-oxochromen-7-yl) 3-chloroadamantane-1-carboxylate Traditional Name: 3-chloroadamantane-1-carboxylic acid (2-keto-4-methyl-chromen-7-yl) ester Formula: C21H21ClO4 MolecularWeight: 372.84204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C34CC5CC(C3)CC(C5)(C4)Cl

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C34CC5CC(C3)CC(C5)(C4)Cl

InChI

InChI=1S/C21H21ClO4/c1-12-4-18(23)26-17-6-15(2-3-16(12)17)25-19(24)20-7-13-5-14(8-20)10-21(22,9-13)11-20/h2-4,6,13-14H,5,7-11H2,1H3