tert-butyl 4-[(3-piperidin-1-ylsulfonylphenyl)carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(3-piperidin-1-ylsulfonylphenyl)carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[3-(1-piperidylsulfonyl)phenyl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[oxo-[3-(1-piperidinylsulfonyl)anilino]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(3-piperidin-1-ylsulfonylphenyl)carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[(3-piperidinosulfonylphenyl)carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H33N3O5S MolecularWeight: 451.57952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H33N3O5S/c1-22(2,3)30-21(27)24-14-10-17(11-15-24)20(26)23-18-8-7-9-19(16-18)31(28,29)25-12-5-4-6-13-25/h7-9,16-17H,4-6,10-15H2,1-3H3,(H,23,26)