(4-methoxycarbonylphenyl)methyl 3-chloranyladamantane-1-carboxylate

Systemtic Name: (4-methoxycarbonylphenyl)methyl 3-chloranyladamantane-1-carboxylate Openeye Name: (4-methoxycarbonylphenyl)methyl 3-chloroadamantane-1-carboxylate CAS Name: 3-chloro-1-adamantanecarboxylic acid (4-methoxycarbonylphenyl)methyl ester IUPAC Name: (4-methoxycarbonylphenyl)methyl 3-chloroadamantane-1-carboxylate Traditional Name: 3-chloroadamantane-1-carboxylic acid (4-carbomethoxybenzyl) ester Formula: C20H23ClO4 MolecularWeight: 362.84722

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC(=O)C23CC4CC(C2)CC(C4)(C3)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC(=O)C23CC4CC(C2)CC(C4)(C3)Cl

InChI

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