1-ethylsulfonyl-N-(2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)piperidine-4-carboxamide

Systemtic Name: 1-ethylsulfonyl-N-(2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl)piperidine-4-carboxamide Openeye Name: 1-ethylsulfonyl-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)piperidine-4-carboxamide CAS Name: 1-ethylsulfonyl-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)-4-piperidinecarboxamide IUPAC Name: 1-ethylsulfonyl-N-(2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl)piperidine-4-carboxamide Traditional Name: 1-esyl-N-(3-keto-2-methyl-4H-1,4-benzoxazin-6-yl)isonipecotamide Formula: C17H23N3O5S MolecularWeight: 381.44662

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC3=C(C=C2)OC(C(=O)N3)C

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC3=C(C=C2)OC(C(=O)N3)C

InChI

InChI=1S/C17H23N3O5S/c1-3-26(23,24)20-8-6-12(7-9-20)17(22)18-13-4-5-15-14(10-13)19-16(21)11(2)25-15/h4-5,10-12H,3,6-9H2,1-2H3,(H,18,22)(H,19,21)