6-nitro-N-[(2,4,5-trimethoxyphenyl)methyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: 6-nitro-N-[(2,4,5-trimethoxyphenyl)methyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: 6-nitro-N-[(2,4,5-trimethoxyphenyl)methyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: 6-nitro-N-[(2,4,5-trimethoxyphenyl)methyl]-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: 6-nitro-N-[(2,4,5-trimethoxyphenyl)methyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: 6-nitro-N-(2,4,5-trimethoxybenzyl)-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C19H20N2O8 MolecularWeight: 404.3707

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CNC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCCO3)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1CNC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCCO3)OC)OC

InChI

InChI=1S/C19H20N2O8/c1-25-14-9-16(27-3)15(26-2)6-11(14)10-20-19(22)12-7-17-18(29-5-4-28-17)8-13(12)21(23)24/h6-9H,4-5,10H2,1-3H3,(H,20,22)