2-azanyl-4-methyl-5-nitro-benzene-1,3-diol

Systemtic Name: 2-azanyl-4-methyl-5-nitro-benzene-1,3-diol Openeye Name: 2-amino-4-methyl-5-nitro-benzene-1,3-diol CAS Name: 2-amino-4-methyl-5-nitrobenzene-1,3-diol IUPAC Name: 2-amino-4-methyl-5-nitrobenzene-1,3-diol Traditional Name: 2-amino-4-methyl-5-nitro-resorcinol Formula: C7H8N2O4 MolecularWeight: 184.14942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1[N+](=O)[O-])O)N)O

Isomeric SMILES

CC1=C(C(=C(C=C1[N+](=O)[O-])O)N)O

InChI

InChI=1S/C7H8N2O4/c1-3-4(9(12)13)2-5(10)6(8)7(3)11/h2,10-11H,8H2,1H3