6-[3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]piperidin-1-yl]sulfonyl-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[3-[(2-oxidanylidenepyrrolidin-1-yl)methyl]piperidin-1-yl]sulfonyl-4H-1,4-benzoxazin-3-one Openeye Name: 6-[[3-[(2-oxopyrrolidin-1-yl)methyl]-1-piperidyl]sulfonyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[[3-[(2-oxo-1-pyrrolidinyl)methyl]-1-piperidinyl]sulfonyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-[(2-oxopyrrolidin-1-yl)methyl]piperidin-1-yl]sulfonyl-4H-1,4-benzoxazin-3-one Traditional Name: 6-[3-[(2-ketopyrrolidino)methyl]piperidino]sulfonyl-4H-1,4-benzoxazin-3-one Formula: C18H23N3O5S MolecularWeight: 393.45732

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3)CN4CCCC4=O

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC3=C(C=C2)OCC(=O)N3)CN4CCCC4=O

InChI

InChI=1S/C18H23N3O5S/c22-17-12-26-16-6-5-14(9-15(16)19-17)27(24,25)21-8-1-3-13(11-21)10-20-7-2-4-18(20)23/h5-6,9,13H,1-4,7-8,10-12H2,(H,19,22)