methyl 1-[2-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)carbonyloxyethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)carbonyloxyethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-[4-methyl-3-(1-piperidylsulfonyl)benzoyl]oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-oxomethoxy]-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(4-methyl-3-piperidin-1-ylsulfonylbenzoyl)oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(4-methyl-3-piperidinosulfonyl-benzoyl)oxyacetyl]isonipecotic acid methyl ester Formula: C22H30N2O7S MolecularWeight: 466.5478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC(=O)N2CCC(CC2)C(=O)OC)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC(=O)N2CCC(CC2)C(=O)OC)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H30N2O7S/c1-16-6-7-18(14-19(16)32(28,29)24-10-4-3-5-11-24)22(27)31-15-20(25)23-12-8-17(9-13-23)21(26)30-2/h6-7,14,17H,3-5,8-13,15H2,1-2H3