N-decyl-2-methyl-quinolin-1-ium-4-amine iodide

Systemtic Name: N-decyl-2-methyl-quinolin-1-ium-4-amine iodide Openeye Name: N-decyl-2-methyl-quinolin-1-ium-4-amine iodide CAS Name: N-decyl-2-methyl-4-quinolin-1-iumamine iodide IUPAC Name: N-decyl-2-methylquinolin-1-ium-4-amine iodide Traditional Name: decyl-(2-methylquinolin-1-ium-4-yl)amine iodide Formula: C20H31IN2 MolecularWeight: 426.37801

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCNC1=CC(=[NH+]C2=CC=CC=C21)C.[I-]

Isomeric SMILES

CCCCCCCCCCNC1=CC(=[NH+]C2=CC=CC=C21)C.[I-]

InChI

InChI=1S/C20H30N2.HI/c1-3-4-5-6-7-8-9-12-15-21-20-16-17(2)22-19-14-11-10-13-18(19)20;/h10-11,13-14,16H,3-9,12,15H2,1-2H3,(H,21,22);1H