methyl 1-[4-methoxy-3-(4-methylpiperidin-1-yl)carbonyl-phenyl]sulfonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-[4-methoxy-3-(4-methylpiperidin-1-yl)carbonyl-phenyl]sulfonylpiperidine-4-carboxylate Openeye Name: methyl 1-[4-methoxy-3-(4-methylpiperidine-1-carbonyl)phenyl]sulfonylpiperidine-4-carboxylate CAS Name: 1-[4-methoxy-3-[(4-methyl-1-piperidinyl)-oxomethyl]phenyl]sulfonyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-methoxy-3-(4-methylpiperidine-1-carbonyl)phenyl]sulfonylpiperidine-4-carboxylate Traditional Name: 1-[4-methoxy-3-(4-methylpiperidine-1-carbonyl)phenyl]sulfonylisonipecotic acid methyl ester Formula: C21H30N2O6S MolecularWeight: 438.5377

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC(CC3)C(=O)OC)OC

Isomeric SMILES

CC1CCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCC(CC3)C(=O)OC)OC

InChI

InChI=1S/C21H30N2O6S/c1-15-6-10-22(11-7-15)20(24)18-14-17(4-5-19(18)28-2)30(26,27)23-12-8-16(9-13-23)21(25)29-3/h4-5,14-16H,6-13H2,1-3H3