N1-methyl-2-nitro-benzene-1,4-diamine

Systemtic Name: N1-methyl-2-nitro-benzene-1,4-diamine Openeye Name: N1-methyl-2-nitro-benzene-1,4-diamine CAS Name: N1-methyl-2-nitrobenzene-1,4-diamine IUPAC Name: 1-N-methyl-2-nitrobenzene-1,4-diamine Traditional Name: (4-amino-2-nitro-phenyl)-methyl-amine Formula: C7H9N3O2 MolecularWeight: 167.16526

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)N)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)N)[N+](=O)[O-]

InChI

InChI=1S/C7H9N3O2/c1-9-6-3-2-5(8)4-7(6)10(11)12/h2-4,9H,8H2,1H3