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

Systemtic Name: N-[(E)-1-(4-methoxy-3-nitro-phenyl)ethylideneamino]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Openeye Name: N-[(E)-1-(4-methoxy-3-nitro-phenyl)ethylideneamino]-2,3-dihydro-1,4-benzodioxine-6-carboxamide CAS Name: N-[(E)-1-(4-methoxy-3-nitrophenyl)ethylideneamino]-2,3-dihydro-1,4-benzodioxin-6-carboxamide IUPAC Name: N-[(E)-1-(4-methoxy-3-nitrophenyl)ethylideneamino]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Traditional Name: N-[(E)-1-(4-methoxy-3-nitro-phenyl)ethylideneamino]-2,3-dihydro-1,4-benzodioxin-6-carboxamide Formula: C18H17N3O6 MolecularWeight: 371.34408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3O6/c1-11(12-3-5-15(25-2)14(9-12)21(23)24)19-20-18(22)13-4-6-16-17(10-13)27-8-7-26-16/h3-6,9-10H,7-8H2,1-2H3,(H,20,22)/b19-11+