[4-chloranyl-2-(phenylmethyl)phenyl] adamantane-1-carboxylate

Systemtic Name: [4-chloranyl-2-(phenylmethyl)phenyl] adamantane-1-carboxylate Openeye Name: (2-benzyl-4-chloro-phenyl) adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [4-chloro-2-(phenylmethyl)phenyl] ester IUPAC Name: (2-benzyl-4-chlorophenyl) adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid (2-benzyl-4-chloro-phenyl) ester Formula: C24H25ClO2 MolecularWeight: 380.9071

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)OC4=C(C=C(C=C4)Cl)CC5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)OC4=C(C=C(C=C4)Cl)CC5=CC=CC=C5

InChI

InChI=1S/C24H25ClO2/c25-21-6-7-22(20(12-21)11-16-4-2-1-3-5-16)27-23(26)24-13-17-8-18(14-24)10-19(9-17)15-24/h1-7,12,17-19H,8-11,13-15H2