N-[3-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: N-[3-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: N-[3-(2-amino-2-oxo-ethoxy)phenyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: N-[3-(2-amino-2-oxoethoxy)phenyl]-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: N-[3-(2-amino-2-oxoethoxy)phenyl]-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: N-[3-(2-amino-2-keto-ethoxy)phenyl]-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C17H15N3O7 MolecularWeight: 373.3169

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)[N+](=O)[O-])C(=O)NC3=CC(=CC=C3)OCC(=O)N

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)[N+](=O)[O-])C(=O)NC3=CC(=CC=C3)OCC(=O)N

InChI

InChI=1S/C17H15N3O7/c18-16(21)9-27-11-3-1-2-10(6-11)19-17(22)12-7-14-15(26-5-4-25-14)8-13(12)20(23)24/h1-3,6-8H,4-5,9H2,(H2,18,21)(H,19,22)