tert-butyl 4-[1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidin-4-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidin-4-yl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-(1-indan-5-ylsulfonylpiperidine-4-carbonyl)piperazine-1-carboxylate CAS Name: 4-[[1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-4-piperidinyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidine-4-carbonyl]piperazine-1-carboxylate Traditional Name: 4-(1-indan-5-ylsulfonylisonipecotoyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C24H35N3O5S MolecularWeight: 477.6168

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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(CCC4)C=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C24H35N3O5S/c1-24(2,3)32-23(29)26-15-13-25(14-16-26)22(28)19-9-11-27(12-10-19)33(30,31)21-8-7-18-5-4-6-20(18)17-21/h7-8,17,19H,4-6,9-16H2,1-3H3