N1-(5-nitroquinolin-8-yl)butane-1,3-diamine hydrochloride

Systemtic Name: N1-(5-nitroquinolin-8-yl)butane-1,3-diamine hydrochloride Openeye Name: N1-(5-nitro-8-quinolyl)butane-1,3-diamine hydrochloride CAS Name: N1-(5-nitro-8-quinolinyl)butane-1,3-diamine hydrochloride IUPAC Name: 1-N-(5-nitroquinolin-8-yl)butane-1,3-diamine hydrochloride Traditional Name: 3-aminobutyl-(5-nitro-8-quinolyl)amine hydrochloride Formula: C13H17ClN4O2 MolecularWeight: 296.75268

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCNC1=C2C(=C(C=C1)[N+](=O)[O-])C=CC=N2)N.Cl

Isomeric SMILES

CC(CCNC1=C2C(=C(C=C1)[N+](=O)[O-])C=CC=N2)N.Cl

InChI

InChI=1S/C13H16N4O2.ClH/c1-9(14)6-8-15-11-4-5-12(17(18)19)10-3-2-7-16-13(10)11;/h2-5,7,9,15H,6,8,14H2,1H3;1H