3-[(3-ethoxycarbonyl-6-methoxycarbonyl-quinolin-1-ium-4-yl)amino]propyl-dimethyl-azanium

Systemtic Name: 3-[(3-ethoxycarbonyl-6-methoxycarbonyl-quinolin-1-ium-4-yl)amino]propyl-dimethyl-azanium Openeye Name: 3-[(3-ethoxycarbonyl-6-methoxycarbonyl-quinolin-1-ium-4-yl)amino]propyl-dimethyl-ammonium CAS Name: 3-[(3-ethoxycarbonyl-6-methoxycarbonyl-4-quinolin-1-iumyl)amino]propyl-dimethylammonium IUPAC Name: 3-[(3-ethoxycarbonyl-6-methoxycarbonylquinolin-1-ium-4-yl)amino]propyl-dimethylazanium Traditional Name: 3-[(3-carbethoxy-6-carbomethoxy-quinolin-1-ium-4-yl)amino]propyl-dimethyl-ammonium Formula: C19H27N3O4+2 MolecularWeight: 361.43538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C[NH+]=C2C=CC(=CC2=C1NCCC[NH+](C)C)C(=O)OC

Isomeric SMILES

CCOC(=O)C1=C[NH+]=C2C=CC(=CC2=C1NCCC[NH+](C)C)C(=O)OC

InChI

InChI=1S/C19H25N3O4/c1-5-26-19(24)15-12-21-16-8-7-13(18(23)25-4)11-14(16)17(15)20-9-6-10-22(2)3/h7-8,11-12H,5-6,9-10H2,1-4H3,(H,20,21)/p+2