N1,2-dimethyl-4-nitro-benzene-1,3-diamine

Systemtic Name: N1,2-dimethyl-4-nitro-benzene-1,3-diamine Openeye Name: N1,2-dimethyl-4-nitro-benzene-1,3-diamine CAS Name: N1,2-dimethyl-4-nitrobenzene-1,3-diamine IUPAC Name: 1-N,2-dimethyl-4-nitrobenzene-1,3-diamine Traditional Name: (3-amino-2-methyl-4-nitro-phenyl)-methyl-amine Formula: C8H11N3O2 MolecularWeight: 181.19184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1N)[N+](=O)[O-])NC

Isomeric SMILES

CC1=C(C=CC(=C1N)[N+](=O)[O-])NC

InChI

InChI=1S/C8H11N3O2/c1-5-6(10-2)3-4-7(8(5)9)11(12)13/h3-4,10H,9H2,1-2H3