(2-cyanophenyl) 3-chloranyladamantane-1-carboxylate

Systemtic Name: (2-cyanophenyl) 3-chloranyladamantane-1-carboxylate Openeye Name: (2-cyanophenyl) 3-chloroadamantane-1-carboxylate CAS Name: 3-chloro-1-adamantanecarboxylic acid (2-cyanophenyl) ester IUPAC Name: (2-cyanophenyl) 3-chloroadamantane-1-carboxylate Traditional Name: 3-chloroadamantane-1-carboxylic acid (2-cyanophenyl) ester Formula: C18H18ClNO2 MolecularWeight: 315.79402

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)Cl)C(=O)OC4=CC=CC=C4C#N

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)Cl)C(=O)OC4=CC=CC=C4C#N

InChI

InChI=1S/C18H18ClNO2/c19-18-8-12-5-13(9-18)7-17(6-12,11-18)16(21)22-15-4-2-1-3-14(15)10-20/h1-4,12-13H,5-9,11H2