tert-butyl 4-[1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperidin-4-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperidin-4-yl]carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-(1-tetralin-6-ylsulfonylpiperidine-4-carbonyl)piperazine-1-carboxylate CAS Name: 4-[oxo-[1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-4-piperidinyl]methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperidine-4-carbonyl]piperazine-1-carboxylate Traditional Name: 4-(1-tetralin-6-ylsulfonylisonipecotoyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C25H37N3O5S MolecularWeight: 491.64338

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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(CCCC4)C=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(CCCC4)C=C3

InChI

InChI=1S/C25H37N3O5S/c1-25(2,3)33-24(30)27-16-14-26(15-17-27)23(29)20-10-12-28(13-11-20)34(31,32)22-9-8-19-6-4-5-7-21(19)18-22/h8-9,18,20H,4-7,10-17H2,1-3H3