5-methyl-2-propan-2-yl-cyclohexan-1-ol; (phenylmethyl) pyridine-3-carboxylate

Systemtic Name: 5-methyl-2-propan-2-yl-cyclohexan-1-ol; (phenylmethyl) pyridine-3-carboxylate Openeye Name: benzyl pyridine-3-carboxylate; 2-isopropyl-5-methyl-cyclohexanol CAS Name: 5-methyl-2-propan-2-yl-1-cyclohexanol; 3-pyridinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl pyridine-3-carboxylate; 5-methyl-2-propan-2-ylcyclohexan-1-ol Traditional Name: 2-isopropyl-5-methyl-cyclohexanol; nicotinic acid benzyl ester Formula: C23H31NO3 MolecularWeight: 369.49714

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)O)C(C)C.C1=CC=C(C=C1)COC(=O)C2=CN=CC=C2

Isomeric SMILES

CC1CCC(C(C1)O)C(C)C.C1=CC=C(C=C1)COC(=O)C2=CN=CC=C2

InChI

InChI=1S/C13H11NO2.C10H20O/c15-13(12-7-4-8-14-9-12)16-10-11-5-2-1-3-6-11;1-7(2)9-5-4-8(3)6-10(9)11/h1-9H,10H2;7-11H,4-6H2,1-3H3