ethyl 1-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[4-methoxy-3-(1-piperidylsulfonyl)benzoyl]piperidine-4-carboxylate CAS Name: 1-[[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-methoxy-3-piperidin-1-ylsulfonylbenzoyl)piperidine-4-carboxylate Traditional Name: 1-(4-methoxy-3-piperidinosulfonyl-benzoyl)isonipecotic acid ethyl ester Formula: C21H30N2O6S MolecularWeight: 438.5377

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H30N2O6S/c1-3-29-21(25)16-9-13-22(14-10-16)20(24)17-7-8-18(28-2)19(15-17)30(26,27)23-11-5-4-6-12-23/h7-8,15-16H,3-6,9-14H2,1-2H3