1-phenyl-N-[[1-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylcarbonyl)piperidin-3-yl]methyl]methanesulfonamide

Systemtic Name: 1-phenyl-N-[[1-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylcarbonyl)piperidin-3-yl]methyl]methanesulfonamide Openeye Name: 1-phenyl-N-[[1-(4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbonyl)-3-piperidyl]methyl]methanesulfonamide CAS Name: N-[[1-[oxo(4,5,6,7-tetrahydro-1,2-benzoxazol-3-yl)methyl]-3-piperidinyl]methyl]-1-phenylmethanesulfonamide IUPAC Name: 1-phenyl-N-[[1-(4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbonyl)piperidin-3-yl]methyl]methanesulfonamide Traditional Name: 1-phenyl-N-[[1-(4,5,6,7-tetrahydroindoxazene-3-carbonyl)-3-piperidyl]methyl]methanesulfonamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=NO2)C(=O)N3CCCC(C3)CNS(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C(=NO2)C(=O)N3CCCC(C3)CNS(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C21H27N3O4S/c25-21(20-18-10-4-5-11-19(18)28-23-20)24-12-6-9-17(14-24)13-22-29(26,27)15-16-7-2-1-3-8-16/h1-3,7-8,17,22H,4-6,9-15H2