(6-methyl-2-prop-2-enoxy-quinolin-3-yl)methyl-(3-morpholin-4-ium-4-ylpropyl)azanium

Systemtic Name: (6-methyl-2-prop-2-enoxy-quinolin-3-yl)methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Openeye Name: (2-allyloxy-6-methyl-3-quinolyl)methyl-(3-morpholin-4-ium-4-ylpropyl)ammonium CAS Name: (6-methyl-2-prop-2-enoxy-3-quinolinyl)methyl-[3-(4-morpholin-4-iumyl)propyl]ammonium IUPAC Name: (6-methyl-2-prop-2-enoxyquinolin-3-yl)methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Traditional Name: (2-allyloxy-6-methyl-3-quinolyl)methyl-(3-morpholin-4-ium-4-ylpropyl)ammonium Formula: C21H31N3O2+2 MolecularWeight: 357.48974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(N=C2C=C1)OCC=C)C[NH2+]CCC[NH+]3CCOCC3

Isomeric SMILES

CC1=CC2=CC(=C(N=C2C=C1)OCC=C)C[NH2+]CCC[NH+]3CCOCC3

InChI

InChI=1S/C21H29N3O2/c1-3-11-26-21-19(15-18-14-17(2)5-6-20(18)23-21)16-22-7-4-8-24-9-12-25-13-10-24/h3,5-6,14-15,22H,1,4,7-13,16H2,2H3/p+2