ethyl 1-[3-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[3-[(3,5-dimethyl-1-piperidyl)sulfonyl]benzoyl]piperidine-4-carboxylate CAS Name: 1-[[3-[(3,5-dimethyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoyl]piperidine-4-carboxylate Traditional Name: 1-[3-(3,5-dimethylpiperidino)sulfonylbenzoyl]isonipecotic acid ethyl ester Formula: C22H32N2O5S MolecularWeight: 436.56488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CC(CC(C3)C)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CC(CC(C3)C)C

InChI

InChI=1S/C22H32N2O5S/c1-4-29-22(26)18-8-10-23(11-9-18)21(25)19-6-5-7-20(13-19)30(27,28)24-14-16(2)12-17(3)15-24/h5-7,13,16-18H,4,8-12,14-15H2,1-3H3