(5-methyl-2-propan-2-yl-cyclohexyl) 2-(phenylmethyl)pyridine-3-carboxylate

Systemtic Name: (5-methyl-2-propan-2-yl-cyclohexyl) 2-(phenylmethyl)pyridine-3-carboxylate Openeye Name: (2-isopropyl-5-methyl-cyclohexyl) 2-benzylpyridine-3-carboxylate CAS Name: 2-(phenylmethyl)-3-pyridinecarboxylic acid (5-methyl-2-propan-2-ylcyclohexyl) ester IUPAC Name: (5-methyl-2-propan-2-ylcyclohexyl) 2-benzylpyridine-3-carboxylate Traditional Name: 2-benzylnicotinic acid (2-isopropyl-5-methyl-cyclohexyl) ester Formula: C23H29NO2 MolecularWeight: 351.48186

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)C2=C(N=CC=C2)CC3=CC=CC=C3)C(C)C

Isomeric SMILES

CC1CCC(C(C1)OC(=O)C2=C(N=CC=C2)CC3=CC=CC=C3)C(C)C

InChI

InChI=1S/C23H29NO2/c1-16(2)19-12-11-17(3)14-22(19)26-23(25)20-10-7-13-24-21(20)15-18-8-5-4-6-9-18/h4-10,13,16-17,19,22H,11-12,14-15H2,1-3H3