(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 4-oxidanylidene-4-phenyl-butanoate

Systemtic Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 4-oxidanylidene-4-phenyl-butanoate Openeye Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 4-oxo-4-phenyl-butanoate CAS Name: 4-oxo-4-phenylbutanoic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 4-oxo-4-phenylbutanoate Traditional Name: 4-keto-4-phenyl-butyric acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C19H17NO7 MolecularWeight: 371.34078

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)COC(=O)CCC(=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)COC(=O)CCC(=O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H17NO7/c21-17(13-4-2-1-3-5-13)6-7-18(22)26-11-15-9-16(20(23)24)8-14-10-25-12-27-19(14)15/h1-5,8-9H,6-7,10-12H2