2,8-dimethyl-N-(3-nitrophenyl)quinolin-1-ium-4-amine chloride

Systemtic Name: 2,8-dimethyl-N-(3-nitrophenyl)quinolin-1-ium-4-amine chloride Openeye Name: 2,8-dimethyl-N-(3-nitrophenyl)quinolin-1-ium-4-amine chloride CAS Name: 2,8-dimethyl-N-(3-nitrophenyl)-4-quinolin-1-iumamine chloride IUPAC Name: 2,8-dimethyl-N-(3-nitrophenyl)quinolin-1-ium-4-amine chloride Traditional Name: (2,8-dimethylquinolin-1-ium-4-yl)-(3-nitrophenyl)amine chloride Formula: C17H16ClN3O2 MolecularWeight: 329.78084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1[NH+]=C(C=C2NC3=CC(=CC=C3)[N+](=O)[O-])C.[Cl-]

Isomeric SMILES

CC1=CC=CC2=C1[NH+]=C(C=C2NC3=CC(=CC=C3)[N+](=O)[O-])C.[Cl-]

InChI

InChI=1S/C17H15N3O2.ClH/c1-11-5-3-8-15-16(9-12(2)18-17(11)15)19-13-6-4-7-14(10-13)20(21)22;/h3-10H,1-2H3,(H,18,19);1H