[(2R)-1-[(5-nitroquinolin-8-yl)amino]propan-2-yl]azanium

Systemtic Name: [(2R)-1-[(5-nitroquinolin-8-yl)amino]propan-2-yl]azanium Openeye Name: [(1R)-1-methyl-2-[(5-nitro-8-quinolyl)amino]ethyl]ammonium CAS Name: [(2R)-1-[(5-nitro-8-quinolinyl)amino]propan-2-yl]ammonium IUPAC Name: [(2R)-1-[(5-nitroquinolin-8-yl)amino]propan-2-yl]azanium Traditional Name: [(1R)-1-methyl-2-[(5-nitro-8-quinolyl)amino]ethyl]ammonium Formula: C12H15N4O2+ MolecularWeight: 247.2731

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=C2C(=C(C=C1)[N+](=O)[O-])C=CC=N2)[NH3+]

Isomeric SMILES

C[C@H](CNC1=C2C(=C(C=C1)[N+](=O)[O-])C=CC=N2)[NH3+]

InChI

InChI=1S/C12H14N4O2/c1-8(13)7-15-10-4-5-11(16(17)18)9-3-2-6-14-12(9)10/h2-6,8,15H,7,13H2,1H3/p+1/t8-/m1/s1