5-[(8-methoxy-1-methyl-quinolin-1-ium-4-yl)amino]pentyl nitrate iodide

Systemtic Name: 5-[(8-methoxy-1-methyl-quinolin-1-ium-4-yl)amino]pentyl nitrate iodide Openeye Name: 5-[(8-methoxy-1-methyl-quinolin-1-ium-4-yl)amino]pentyl nitrate iodide CAS Name: nitric acid 5-[(8-methoxy-1-methyl-4-quinolin-1-iumyl)amino]pentyl ester iodide IUPAC Name: 5-[(8-methoxy-1-methylquinolin-1-ium-4-yl)amino]pentyl nitrate iodide Traditional Name: nitric acid 5-[(8-methoxy-1-methyl-quinolin-1-ium-4-yl)amino]pentyl ester iodide Formula: C16H22IN3O4 MolecularWeight: 447.26805

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C(=C(C=C1)NCCCCCO[N+](=O)[O-])C=CC=C2OC.[I-]

Isomeric SMILES

C[N+]1=C2C(=C(C=C1)NCCCCCO[N+](=O)[O-])C=CC=C2OC.[I-]

InChI

InChI=1S/C16H21N3O4.HI/c1-18-11-9-14(13-7-6-8-15(22-2)16(13)18)17-10-4-3-5-12-23-19(20)21;/h6-9,11H,3-5,10,12H2,1-2H3;1H