N-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: N-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: N-[2-(4-fluoroanilino)-2-oxo-ethyl]-N-methyl-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: N-[2-(4-fluoroanilino)-2-oxoethyl]-N-methyl-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: N-[2-(4-fluoroanilino)-2-oxoethyl]-N-methyl-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: N-[2-(4-fluoroanilino)-2-keto-ethyl]-N-methyl-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C18H16FN3O6 MolecularWeight: 389.334543

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=C(C=C1)F)C(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCCO3

Isomeric SMILES

CN(CC(=O)NC1=CC=C(C=C1)F)C(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCCO3

InChI

InChI=1S/C18H16FN3O6/c1-21(10-17(23)20-12-4-2-11(19)3-5-12)18(24)13-8-15-16(28-7-6-27-15)9-14(13)22(25)26/h2-5,8-9H,6-7,10H2,1H3,(H,20,23)