N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]-1H-indazol-6-amine

Systemtic Name: N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]-1H-indazol-6-amine Openeye Name: N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]-1H-indazol-6-amine CAS Name: N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]-1H-indazol-6-amine IUPAC Name: N-[(6-nitro-1,3-benzodioxol-5-yl)methyl]-1H-indazol-6-amine Traditional Name: 1H-indazol-6-yl-[(6-nitro-1,3-benzodioxol-5-yl)methyl]amine Formula: C15H12N4O4 MolecularWeight: 312.28018

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)CNC3=CC4=C(C=C3)C=NN4)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)CNC3=CC4=C(C=C3)C=NN4)[N+](=O)[O-]

InChI

InChI=1S/C15H12N4O4/c20-19(21)13-5-15-14(22-8-23-15)3-10(13)6-16-11-2-1-9-7-17-18-12(9)4-11/h1-5,7,16H,6,8H2,(H,17,18)