N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-nitro-3-oxidanyl-benzamide

Systemtic Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-4-nitro-3-oxidanyl-benzamide Openeye Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-3-hydroxy-4-nitro-benzamide CAS Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-3-hydroxy-4-nitrobenzamide IUPAC Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-3-hydroxy-4-nitrobenzamide Traditional Name: N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-3-hydroxy-4-nitro-benzamide Formula: C17H16N2O6 MolecularWeight: 344.31874

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CCNC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CCNC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])O

InChI

InChI=1S/C17H16N2O6/c20-14-10-12(2-3-13(14)19(22)23)17(21)18-6-5-11-1-4-15-16(9-11)25-8-7-24-15/h1-4,9-10,20H,5-8H2,(H,18,21)