[4-(phenylcarbamoyl)phenyl]methyl 6-nitro-1,3-benzodioxole-5-carboxylate

Systemtic Name: [4-(phenylcarbamoyl)phenyl]methyl 6-nitro-1,3-benzodioxole-5-carboxylate Openeye Name: [4-(phenylcarbamoyl)phenyl]methyl 6-nitro-1,3-benzodioxole-5-carboxylate CAS Name: 6-nitro-1,3-benzodioxole-5-carboxylic acid [4-[anilino(oxo)methyl]phenyl]methyl ester IUPAC Name: [4-(phenylcarbamoyl)phenyl]methyl 6-nitro-1,3-benzodioxole-5-carboxylate Traditional Name: 6-nitro-piperonylic acid [4-(phenylcarbamoyl)benzyl] ester Formula: C22H16N2O7 MolecularWeight: 420.37164

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C(=O)OCC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)C(=O)OCC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H16N2O7/c25-21(23-16-4-2-1-3-5-16)15-8-6-14(7-9-15)12-29-22(26)17-10-19-20(31-13-30-19)11-18(17)24(27)28/h1-11H,12-13H2,(H,23,25)