1-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-nitro-2-phenyl-guanidine

Systemtic Name: 1-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-nitro-2-phenyl-guanidine Openeye Name: 1-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-3-nitro-2-phenyl-guanidine CAS Name: 1-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-nitro-2-phenylguanidine IUPAC Name: 1-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-nitro-2-phenylguanidine Traditional Name: 1-nitro-2-phenyl-3-[(E)-piperonylideneamino]guanidine Formula: C15H13N5O4 MolecularWeight: 327.29482

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13N5O4/c21-20(22)19-15(17-12-4-2-1-3-5-12)18-16-9-11-6-7-13-14(8-11)24-10-23-13/h1-9H,10H2,(H2,17,18,19)/b16-9+