5-[[cyclohexyl(methyl)azaniumyl]methyl]-7-nitro-quinolin-8-olate

Systemtic Name: 5-[[cyclohexyl(methyl)azaniumyl]methyl]-7-nitro-quinolin-8-olate Openeye Name: 5-[[cyclohexyl(methyl)ammonio]methyl]-7-nitro-quinolin-8-olate CAS Name: 5-[[cyclohexyl(methyl)ammonio]methyl]-7-nitro-8-quinolinolate IUPAC Name: 5-[[cyclohexyl(methyl)azaniumyl]methyl]-7-nitroquinolin-8-olate Traditional Name: 5-[[cyclohexyl(methyl)ammonio]methyl]-7-nitro-quinolin-8-olate Formula: C17H21N3O3 MolecularWeight: 315.36694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=C(C2=C1C=CC=N2)[O-])[N+](=O)[O-])C3CCCCC3

Isomeric SMILES

C[NH+](CC1=CC(=C(C2=C1C=CC=N2)[O-])[N+](=O)[O-])C3CCCCC3

InChI

InChI=1S/C17H21N3O3/c1-19(13-6-3-2-4-7-13)11-12-10-15(20(22)23)17(21)16-14(12)8-5-9-18-16/h5,8-10,13,21H,2-4,6-7,11H2,1H3