1-[(4-azanyl-2,3-dimethyl-5-nitro-phenyl)amino]propane-2,2-diol

Systemtic Name: 1-[(4-azanyl-2,3-dimethyl-5-nitro-phenyl)amino]propane-2,2-diol Openeye Name: 1-(4-amino-2,3-dimethyl-5-nitro-anilino)propane-2,2-diol CAS Name: 1-(4-amino-2,3-dimethyl-5-nitroanilino)propane-2,2-diol IUPAC Name: 1-(4-amino-2,3-dimethyl-5-nitroanilino)propane-2,2-diol Traditional Name: 1-(4-amino-2,3-dimethyl-5-nitro-anilino)propane-2,2-diol Formula: C11H17N3O4 MolecularWeight: 255.27038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1NCC(C)(O)O)[N+](=O)[O-])N)C

Isomeric SMILES

CC1=C(C(=C(C=C1NCC(C)(O)O)[N+](=O)[O-])N)C

InChI

InChI=1S/C11H17N3O4/c1-6-7(2)10(12)9(14(17)18)4-8(6)13-5-11(3,15)16/h4,13,15-16H,5,12H2,1-3H3