6-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]sulfonyl-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]sulfonyl-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]sulfonyl-4H-1,4-benzoxazin-3-one CAS Name: 6-[[2-(3,4-dimethoxyphenyl)-1-pyrrolidinyl]sulfonyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]sulfonyl-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-(3,4-dimethoxyphenyl)pyrrolidino]sulfonyl-4H-1,4-benzoxazin-3-one Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CCCN2S(=O)(=O)C3=CC4=C(C=C3)OCC(=O)N4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CCCN2S(=O)(=O)C3=CC4=C(C=C3)OCC(=O)N4)OC

InChI

InChI=1S/C20H22N2O6S/c1-26-18-7-5-13(10-19(18)27-2)16-4-3-9-22(16)29(24,25)14-6-8-17-15(11-14)21-20(23)12-28-17/h5-8,10-11,16H,3-4,9,12H2,1-2H3,(H,21,23)