[2-(3-chloranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] adamantane-2-carboxylate

Systemtic Name: [2-(3-chloranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] adamantane-2-carboxylate Openeye Name: [2-(3-chloro-4-methoxy-phenyl)-2-oxo-ethyl] adamantane-2-carboxylate CAS Name: 2-adamantanecarboxylic acid [2-(3-chloro-4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-chloro-4-methoxyphenyl)-2-oxoethyl] adamantane-2-carboxylate Traditional Name: adamantane-2-carboxylic acid [2-(3-chloro-4-methoxy-phenyl)-2-keto-ethyl] ester Formula: C20H23ClO4 MolecularWeight: 362.84722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23ClO4/c1-24-18-3-2-13(9-16(18)21)17(22)10-25-20(23)19-14-5-11-4-12(7-14)8-15(19)6-11/h2-3,9,11-12,14-15,19H,4-8,10H2,1H3