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

Systemtic Name: 5-[(8-methoxy-1-methyl-quinolin-1-ium-4-yl)amino]pentyl nitrate Openeye Name: 5-[(8-methoxy-1-methyl-quinolin-1-ium-4-yl)amino]pentyl nitrate CAS Name: nitric acid 5-[(8-methoxy-1-methyl-4-quinolin-1-iumyl)amino]pentyl ester IUPAC Name: 5-[(8-methoxy-1-methylquinolin-1-ium-4-yl)amino]pentyl nitrate Traditional Name: nitric acid 5-[(8-methoxy-1-methyl-quinolin-1-ium-4-yl)amino]pentyl ester Formula: C16H22N3O4+ MolecularWeight: 320.36358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O4/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/p+1