methyl 1-(4-methoxy-3-piperidin-1-ylcarbonyl-phenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-(4-methoxy-3-piperidin-1-ylcarbonyl-phenyl)sulfonylpiperidine-4-carboxylate Openeye Name: methyl 1-[4-methoxy-3-(piperidine-1-carbonyl)phenyl]sulfonylpiperidine-4-carboxylate CAS Name: 1-[4-methoxy-3-[oxo(1-piperidinyl)methyl]phenyl]sulfonyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-methoxy-3-(piperidine-1-carbonyl)phenyl]sulfonylpiperidine-4-carboxylate Traditional Name: 1-[4-methoxy-3-(piperidine-1-carbonyl)phenyl]sulfonylisonipecotic acid methyl ester Formula: C20H28N2O6S MolecularWeight: 424.51112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OC)C(=O)N3CCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OC)C(=O)N3CCCCC3

InChI

InChI=1S/C20H28N2O6S/c1-27-18-7-6-16(14-17(18)19(23)21-10-4-3-5-11-21)29(25,26)22-12-8-15(9-13-22)20(24)28-2/h6-7,14-15H,3-5,8-13H2,1-2H3