N-[(E)-1-(4-nitrophenyl)ethylideneamino]-2,3-dihydro-1,4-benzodioxine-6-carboxamide

Systemtic Name: N-[(E)-1-(4-nitrophenyl)ethylideneamino]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Openeye Name: N-[(E)-1-(4-nitrophenyl)ethylideneamino]-2,3-dihydro-1,4-benzodioxine-6-carboxamide CAS Name: N-[(E)-1-(4-nitrophenyl)ethylideneamino]-2,3-dihydro-1,4-benzodioxin-6-carboxamide IUPAC Name: N-[(E)-1-(4-nitrophenyl)ethylideneamino]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Traditional Name: N-[(E)-1-(4-nitrophenyl)ethylideneamino]-2,3-dihydro-1,4-benzodioxin-6-carboxamide Formula: C17H15N3O5 MolecularWeight: 341.3181

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC2=C(C=C1)OCCO2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C/C(=N\NC(=O)C1=CC2=C(C=C1)OCCO2)/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N3O5/c1-11(12-2-5-14(6-3-12)20(22)23)18-19-17(21)13-4-7-15-16(10-13)25-9-8-24-15/h2-7,10H,8-9H2,1H3,(H,19,21)/b18-11+