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

Systemtic Name: 2-[(5-nitroquinolin-8-yl)amino]ethyl-[(2R)-1-oxidanylpropan-2-yl]azanium Openeye Name: [(1R)-2-hydroxy-1-methyl-ethyl]-[2-[(5-nitro-8-quinolyl)amino]ethyl]ammonium CAS Name: [(2R)-1-hydroxypropan-2-yl]-[2-[(5-nitro-8-quinolinyl)amino]ethyl]ammonium IUPAC Name: [(2R)-1-hydroxypropan-2-yl]-[2-[(5-nitroquinolin-8-yl)amino]ethyl]azanium Traditional Name: [(1R)-2-hydroxy-1-methyl-ethyl]-[2-[(5-nitro-8-quinolyl)amino]ethyl]ammonium Formula: C14H19N4O3+ MolecularWeight: 291.32566

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)[NH2+]CCNC1=C2C(=C(C=C1)[N+](=O)[O-])C=CC=N2

Isomeric SMILES

C[C@H](CO)[NH2+]CCNC1=C2C(=C(C=C1)[N+](=O)[O-])C=CC=N2

InChI

InChI=1S/C14H18N4O3/c1-10(9-19)15-7-8-16-12-4-5-13(18(20)21)11-3-2-6-17-14(11)12/h2-6,10,15-16,19H,7-9H2,1H3/p+1/t10-/m1/s1