[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl] adamantane-2-carboxylate

Systemtic Name: [2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl] adamantane-2-carboxylate Openeye Name: [2-(3,4-dimethoxyphenyl)-2-oxo-ethyl] adamantane-2-carboxylate CAS Name: 2-adamantanecarboxylic acid [2-(3,4-dimethoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethoxyphenyl)-2-oxoethyl] adamantane-2-carboxylate Traditional Name: adamantane-2-carboxylic acid [2-(3,4-dimethoxyphenyl)-2-keto-ethyl] ester Formula: C21H26O5 MolecularWeight: 358.42814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)COC(=O)C2C3CC4CC(C3)CC2C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)COC(=O)C2C3CC4CC(C3)CC2C4)OC

InChI

InChI=1S/C21H26O5/c1-24-18-4-3-14(10-19(18)25-2)17(22)11-26-21(23)20-15-6-12-5-13(8-15)9-16(20)7-12/h3-4,10,12-13,15-16,20H,5-9,11H2,1-2H3