tert-butyl 4-[1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidin-4-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidin-4-yl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidine-4-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-piperidinyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidine-4-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)isonipecotoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C23H33N3O7S MolecularWeight: 495.58902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C23H33N3O7S/c1-23(2,3)33-22(28)25-12-10-24(11-13-25)21(27)17-6-8-26(9-7-17)34(29,30)18-4-5-19-20(16-18)32-15-14-31-19/h4-5,16-17H,6-15H2,1-3H3