N-(1,3-benzodioxol-5-yl)-5-nitro-6-(2-phenylhydrazinyl)pyrimidin-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-yl)-5-nitro-6-(2-phenylhydrazinyl)pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-yl)-5-nitro-6-(2-phenylhydrazino)pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-yl)-5-nitro-6-(phenylhydrazo)-4-pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-yl)-5-nitro-6-(2-phenylhydrazinyl)pyrimidin-4-amine Traditional Name: 1,3-benzodioxol-5-yl-[5-nitro-6-(N'-phenylhydrazino)pyrimidin-4-yl]amine Formula: C17H14N6O4 MolecularWeight: 366.33086

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC3=C(C(=NC=N3)NNC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC3=C(C(=NC=N3)NNC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H14N6O4/c24-23(25)15-16(20-12-6-7-13-14(8-12)27-10-26-13)18-9-19-17(15)22-21-11-4-2-1-3-5-11/h1-9,21H,10H2,(H2,18,19,20,22)