(2-oxidanylidene-2-phenylazanyl-ethyl) 6-nitro-1,3-benzodioxole-5-carboxylate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 6-nitro-1,3-benzodioxole-5-carboxylate Openeye Name: (2-anilino-2-oxo-ethyl) 6-nitro-1,3-benzodioxole-5-carboxylate CAS Name: 6-nitro-1,3-benzodioxole-5-carboxylic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 6-nitro-1,3-benzodioxole-5-carboxylate Traditional Name: 6-nitro-piperonylic acid (2-anilino-2-keto-ethyl) ester Formula: C16H12N2O7 MolecularWeight: 344.27568

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C(=O)OCC(=O)NC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)C(=O)OCC(=O)NC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O7/c19-15(17-10-4-2-1-3-5-10)8-23-16(20)11-6-13-14(25-9-24-13)7-12(11)18(21)22/h1-7H,8-9H2,(H,17,19)