(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl 1-(phenylmethyl)cyclohexane-1-carboxylate

Systemtic Name: (3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl 1-(phenylmethyl)cyclohexane-1-carboxylate Openeye Name: [3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]methyl 1-benzylcyclohexanecarboxylate CAS Name: 1-(phenylmethyl)-1-cyclohexanecarboxylic acid [3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: (3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl 1-benzylcyclohexane-1-carboxylate Traditional Name: 1-benzylcyclohexanecarboxylic acid [3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CC2=CC=CC=C2)C(=O)OCC3=NC(=NO3)C4=CN=CC=C4

Isomeric SMILES

C1CCC(CC1)(CC2=CC=CC=C2)C(=O)OCC3=NC(=NO3)C4=CN=CC=C4

InChI

InChI=1S/C22H23N3O3/c26-21(22(11-5-2-6-12-22)14-17-8-3-1-4-9-17)27-16-19-24-20(25-28-19)18-10-7-13-23-15-18/h1,3-4,7-10,13,15H,2,5-6,11-12,14,16H2