tert-butyl 3-[[phenyl(quinolin-8-ylsulfonyl)amino]methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[[phenyl(quinolin-8-ylsulfonyl)amino]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[[N-(8-quinolylsulfonyl)anilino]methyl]piperidine-1-carboxylate CAS Name: 3-[[N-(8-quinolinylsulfonyl)anilino]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(N-quinolin-8-ylsulfonylanilino)methyl]piperidine-1-carboxylate Traditional Name: 3-[[N-(8-quinolylsulfonyl)anilino]methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C26H31N3O4S MolecularWeight: 481.60704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)CN(C2=CC=CC=C2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)CN(C2=CC=CC=C2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C26H31N3O4S/c1-26(2,3)33-25(30)28-17-9-10-20(18-28)19-29(22-13-5-4-6-14-22)34(31,32)23-15-7-11-21-12-8-16-27-24(21)23/h4-8,11-16,20H,9-10,17-19H2,1-3H3