N-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-2-nitro-aniline

Systemtic Name: N-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-2-nitro-aniline Openeye Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-2-nitro-aniline CAS Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-2-nitroaniline IUPAC Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-2-nitroaniline Traditional Name: (6-bromo-1,3-benzodioxol-5-yl)methyl-(2-nitrophenyl)amine Formula: C14H11BrN2O4 MolecularWeight: 351.15214

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)CNC3=CC=CC=C3[N+](=O)[O-])Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)CNC3=CC=CC=C3[N+](=O)[O-])Br

InChI

InChI=1S/C14H11BrN2O4/c15-10-6-14-13(20-8-21-14)5-9(10)7-16-11-3-1-2-4-12(11)17(18)19/h1-6,16H,7-8H2