N-[3-(1,3-benzodioxol-5-ylcarbonylamino)-4-nitro-phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[3-(1,3-benzodioxol-5-ylcarbonylamino)-4-nitro-phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[3-(1,3-benzodioxole-5-carbonylamino)-4-nitro-phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-4-nitrophenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-(1,3-benzodioxole-5-carbonylamino)-4-nitrophenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-nitro-3-(piperonyloylamino)phenyl]-piperonylamide Formula: C22H15N3O8 MolecularWeight: 449.3698

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CC(=C(C=C3)[N+](=O)[O-])NC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CC(=C(C=C3)[N+](=O)[O-])NC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H15N3O8/c26-21(12-1-5-17-19(7-12)32-10-30-17)23-14-3-4-16(25(28)29)15(9-14)24-22(27)13-2-6-18-20(8-13)33-11-31-18/h1-9H,10-11H2,(H,23,26)(H,24,27)