tert-butyl 4-[4-(naphthalen-1-ylsulfonylamino)naphthalen-1-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(naphthalen-1-ylsulfonylamino)naphthalen-1-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-(1-naphthylsulfonylamino)-1-naphthyl]piperazine-1-carboxylate CAS Name: 4-[4-(1-naphthalenylsulfonylamino)-1-naphthalenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(naphthalen-1-ylsulfonylamino)naphthalen-1-yl]piperazine-1-carboxylate Traditional Name: 4-[4-(1-naphthylsulfonylamino)-1-naphthyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C29H31N3O4S MolecularWeight: 517.63914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=C(C3=CC=CC=C32)NS(=O)(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=C(C3=CC=CC=C32)NS(=O)(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C29H31N3O4S/c1-29(2,3)36-28(33)32-19-17-31(18-20-32)26-16-15-25(23-12-6-7-13-24(23)26)30-37(34,35)27-14-8-10-21-9-4-5-11-22(21)27/h4-16,30H,17-20H2,1-3H3