2-[(7-chloranyl-3-ethoxycarbonyl-8-methyl-quinolin-1-ium-4-yl)amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(7-chloranyl-3-ethoxycarbonyl-8-methyl-quinolin-1-ium-4-yl)amino]ethyl-dimethyl-azanium Openeye Name: 2-[(7-chloro-3-ethoxycarbonyl-8-methyl-quinolin-1-ium-4-yl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[(7-chloro-3-ethoxycarbonyl-8-methyl-4-quinolin-1-iumyl)amino]ethyl-dimethylammonium IUPAC Name: 2-[(7-chloro-3-ethoxycarbonyl-8-methylquinolin-1-ium-4-yl)amino]ethyl-dimethylazanium Traditional Name: 2-[(3-carbethoxy-7-chloro-8-methyl-quinolin-1-ium-4-yl)amino]ethyl-dimethyl-ammonium Formula: C17H24ClN3O2+2 MolecularWeight: 337.84436

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C[NH+]=C2C(=C(C=CC2=C1NCC[NH+](C)C)Cl)C

Isomeric SMILES

CCOC(=O)C1=C[NH+]=C2C(=C(C=CC2=C1NCC[NH+](C)C)Cl)C

InChI

InChI=1S/C17H22ClN3O2/c1-5-23-17(22)13-10-20-15-11(2)14(18)7-6-12(15)16(13)19-8-9-21(3)4/h6-7,10H,5,8-9H2,1-4H3,(H,19,20)/p+2