2-[(3-ethoxycarbonylbenzo[h]quinolin-1-ium-4-yl)amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(3-ethoxycarbonylbenzo[h]quinolin-1-ium-4-yl)amino]ethyl-dimethyl-azanium Openeye Name: 2-[(3-ethoxycarbonylbenzo[h]quinolin-1-ium-4-yl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[(3-ethoxycarbonyl-4-benzo[h]quinolin-1-iumyl)amino]ethyl-dimethylammonium IUPAC Name: 2-[(3-ethoxycarbonylbenzo[h]quinolin-1-ium-4-yl)amino]ethyl-dimethylazanium Traditional Name: 2-[(3-carbethoxybenzo[h]quinolin-1-ium-4-yl)amino]ethyl-dimethyl-ammonium Formula: C20H25N3O2+2 MolecularWeight: 339.4314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C[NH+]=C2C(=C1NCC[NH+](C)C)C=CC3=CC=CC=C32

Isomeric SMILES

CCOC(=O)C1=C[NH+]=C2C(=C1NCC[NH+](C)C)C=CC3=CC=CC=C32

InChI

InChI=1S/C20H23N3O2/c1-4-25-20(24)17-13-22-18-15-8-6-5-7-14(15)9-10-16(18)19(17)21-11-12-23(2)3/h5-10,13H,4,11-12H2,1-3H3,(H,21,22)/p+2