4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(2-methoxy-5-nitro-phenyl)-4-oxidanylidene-butanamide

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(2-methoxy-5-nitro-phenyl)-4-oxidanylidene-butanamide Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(2-methoxy-5-nitro-phenyl)-4-oxo-butanamide CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(2-methoxy-5-nitrophenyl)-4-oxobutanamide IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(2-methoxy-5-nitrophenyl)-4-oxobutanamide Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-keto-N-(2-methoxy-5-nitro-phenyl)butyramide Formula: C19H18N2O7 MolecularWeight: 386.35542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CCC(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CCC(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C19H18N2O7/c1-26-16-6-3-13(21(24)25)11-14(16)20-19(23)7-4-15(22)12-2-5-17-18(10-12)28-9-8-27-17/h2-3,5-6,10-11H,4,7-9H2,1H3,(H,20,23)