[(2S)-3-[(5-nitroquinolin-8-yl)amino]-2-oxidanyl-propyl]azanium

Systemtic Name: [(2S)-3-[(5-nitroquinolin-8-yl)amino]-2-oxidanyl-propyl]azanium Openeye Name: [(2S)-2-hydroxy-3-[(5-nitro-8-quinolyl)amino]propyl]ammonium CAS Name: [(2S)-2-hydroxy-3-[(5-nitro-8-quinolinyl)amino]propyl]ammonium IUPAC Name: [(2S)-2-hydroxy-3-[(5-nitroquinolin-8-yl)amino]propyl]azanium Traditional Name: [(2S)-2-hydroxy-3-[(5-nitro-8-quinolyl)amino]propyl]ammonium Formula: C12H15N4O3+ MolecularWeight: 263.2725

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2N=C1)NCC(C[NH3+])O)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=CC(=C2N=C1)NC[C@H](C[NH3+])O)[N+](=O)[O-]

InChI

InChI=1S/C12H14N4O3/c13-6-8(17)7-15-10-3-4-11(16(18)19)9-2-1-5-14-12(9)10/h1-5,8,15,17H,6-7,13H2/p+1/t8-/m0/s1