[2-(4-ethylphenyl)pyridin-3-yl] adamantane-1-carboxylate

Systemtic Name: [2-(4-ethylphenyl)pyridin-3-yl] adamantane-1-carboxylate Openeye Name: [2-(4-ethylphenyl)-3-pyridyl] adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [2-(4-ethylphenyl)-3-pyridinyl] ester IUPAC Name: [2-(4-ethylphenyl)pyridin-3-yl] adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid [2-(4-ethylphenyl)-3-pyridyl] ester Formula: C24H27NO2 MolecularWeight: 361.47668

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=C(C=CC=N2)OC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCC1=CC=C(C=C1)C2=C(C=CC=N2)OC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H27NO2/c1-2-16-5-7-20(8-6-16)22-21(4-3-9-25-22)27-23(26)24-13-17-10-18(14-24)12-19(11-17)15-24/h3-9,17-19H,2,10-15H2,1H3