N-(1,3-benzodioxol-4-ylmethyl)-2-bromanyl-4-nitro-aniline

Systemtic Name: N-(1,3-benzodioxol-4-ylmethyl)-2-bromanyl-4-nitro-aniline Openeye Name: N-(1,3-benzodioxol-4-ylmethyl)-2-bromo-4-nitro-aniline CAS Name: N-(1,3-benzodioxol-4-ylmethyl)-2-bromo-4-nitroaniline IUPAC Name: N-(1,3-benzodioxol-4-ylmethyl)-2-bromo-4-nitroaniline Traditional Name: 1,3-benzodioxol-4-ylmethyl-(2-bromo-4-nitro-phenyl)amine Formula: C14H11BrN2O4 MolecularWeight: 351.15214

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=CC=CC(=C2O1)CNC3=C(C=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

C1OC2=CC=CC(=C2O1)CNC3=C(C=C(C=C3)[N+](=O)[O-])Br

InChI

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