propan-2-yl 4-[[5-(4-methylsulfonylphenyl)pyridin-2-yl]oxymethyl]piperidine-1-carboxylate

Systemtic Name: propan-2-yl 4-[[5-(4-methylsulfonylphenyl)pyridin-2-yl]oxymethyl]piperidine-1-carboxylate Openeye Name: isopropyl 4-[[5-(4-methylsulfonylphenyl)-2-pyridyl]oxymethyl]piperidine-1-carboxylate CAS Name: 4-[[5-(4-methylsulfonylphenyl)-2-pyridinyl]oxymethyl]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[5-(4-methylsulfonylphenyl)pyridin-2-yl]oxymethyl]piperidine-1-carboxylate Traditional Name: 4-[[5-(4-mesylphenyl)-2-pyridyl]oxymethyl]piperidine-1-carboxylic acid isopropyl ester Formula: C22H28N2O5S MolecularWeight: 432.53312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)N1CCC(CC1)COC2=NC=C(C=C2)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC(C)OC(=O)N1CCC(CC1)COC2=NC=C(C=C2)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C22H28N2O5S/c1-16(2)29-22(25)24-12-10-17(11-13-24)15-28-21-9-6-19(14-23-21)18-4-7-20(8-5-18)30(3,26)27/h4-9,14,16-17H,10-13,15H2,1-3H3