3-[(3-methyl-4-nitro-phenyl)amino]propane-1,2-diol

Systemtic Name: 3-[(3-methyl-4-nitro-phenyl)amino]propane-1,2-diol Openeye Name: 3-(3-methyl-4-nitro-anilino)propane-1,2-diol CAS Name: 3-(3-methyl-4-nitroanilino)propane-1,2-diol IUPAC Name: 3-(3-methyl-4-nitroanilino)propane-1,2-diol Traditional Name: 3-(3-methyl-4-nitro-anilino)propane-1,2-diol Formula: C10H14N2O4 MolecularWeight: 226.22916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14N2O4/c1-7-4-8(11-5-9(14)6-13)2-3-10(7)12(15)16/h2-4,9,11,13-14H,5-6H2,1H3