3-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethylidene]-6-ethylsulfonyl-4H-1,4-benzoxazin-2-one

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethylidene]-6-ethylsulfonyl-4H-1,4-benzoxazin-2-one Openeye Name: 3-[2-(3,4-dimethoxyphenyl)-2-oxo-ethylidene]-6-ethylsulfonyl-4H-1,4-benzoxazin-2-one CAS Name: 3-[2-(3,4-dimethoxyphenyl)-2-oxoethylidene]-6-ethylsulfonyl-4H-1,4-benzoxazin-2-one IUPAC Name: 3-[2-(3,4-dimethoxyphenyl)-2-oxoethylidene]-6-ethylsulfonyl-4H-1,4-benzoxazin-2-one Traditional Name: 3-[2-(3,4-dimethoxyphenyl)-2-keto-ethylidene]-6-esyl-4H-1,4-benzoxazin-2-one Formula: C20H19NO7S MolecularWeight: 417.43236

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=O)C(=CC(=O)C3=CC(=C(C=C3)OC)OC)N2

Isomeric SMILES

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=O)C(=CC(=O)C3=CC(=C(C=C3)OC)OC)N2

InChI

InChI=1S/C20H19NO7S/c1-4-29(24,25)13-6-8-17-14(10-13)21-15(20(23)28-17)11-16(22)12-5-7-18(26-2)19(9-12)27-3/h5-11,21H,4H2,1-3H3