1-[(2-chloranyl-5-nitro-phenyl)methyl]quinolin-1-ium bromide

Systemtic Name: 1-[(2-chloranyl-5-nitro-phenyl)methyl]quinolin-1-ium bromide Openeye Name: 1-[(2-chloro-5-nitro-phenyl)methyl]quinolin-1-ium bromide CAS Name: 1-[(2-chloro-5-nitrophenyl)methyl]quinolin-1-ium bromide IUPAC Name: 1-[(2-chloro-5-nitrophenyl)methyl]quinolin-1-ium bromide Traditional Name: 1-(2-chloro-5-nitro-benzyl)quinolin-1-ium bromide Formula: C16H12BrClN2O2 MolecularWeight: 379.63568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=[N+]2CC3=C(C=CC(=C3)[N+](=O)[O-])Cl.[Br-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=[N+]2CC3=C(C=CC(=C3)[N+](=O)[O-])Cl.[Br-]

InChI

InChI=1S/C16H12ClN2O2.BrH/c17-15-8-7-14(19(20)21)10-13(15)11-18-9-3-5-12-4-1-2-6-16(12)18;/h1-10H,11H2;1H/q+1;/p-1