3-[(8-methyl-5-nitro-quinolin-4-yl)amino]propane-1,2-diol

Systemtic Name: 3-[(8-methyl-5-nitro-quinolin-4-yl)amino]propane-1,2-diol Openeye Name: 3-[(8-methyl-5-nitro-4-quinolyl)amino]propane-1,2-diol CAS Name: 3-[(8-methyl-5-nitro-4-quinolinyl)amino]propane-1,2-diol IUPAC Name: 3-[(8-methyl-5-nitroquinolin-4-yl)amino]propane-1,2-diol Traditional Name: 3-[(8-methyl-5-nitro-4-quinolyl)amino]propane-1,2-diol Formula: C13H15N3O4 MolecularWeight: 277.2759

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)[N+](=O)[O-])C(=CC=N2)NCC(CO)O

Isomeric SMILES

CC1=C2C(=C(C=C1)[N+](=O)[O-])C(=CC=N2)NCC(CO)O

InChI

InChI=1S/C13H15N3O4/c1-8-2-3-11(16(19)20)12-10(4-5-14-13(8)12)15-6-9(18)7-17/h2-5,9,17-18H,6-7H2,1H3,(H,14,15)