2-(3,4-dimethoxyphenyl)ethyl-[(3-ethoxycarbonyl-4-methyl-quinolin-2-yl)methyl]-methyl-azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-[(3-ethoxycarbonyl-4-methyl-quinolin-2-yl)methyl]-methyl-azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-[(3-ethoxycarbonyl-4-methyl-2-quinolyl)methyl]-methyl-ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-[(3-ethoxycarbonyl-4-methyl-2-quinolinyl)methyl]-methylammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-[(3-ethoxycarbonyl-4-methylquinolin-2-yl)methyl]-methylazanium Traditional Name: (3-carbethoxy-4-methyl-2-quinolyl)methyl-homoveratryl-methyl-ammonium Formula: C25H31N2O4+ MolecularWeight: 423.52464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1C[NH+](C)CCC3=CC(=C(C=C3)OC)OC)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1C[NH+](C)CCC3=CC(=C(C=C3)OC)OC)C

InChI

InChI=1S/C25H30N2O4/c1-6-31-25(28)24-17(2)19-9-7-8-10-20(19)26-21(24)16-27(3)14-13-18-11-12-22(29-4)23(15-18)30-5/h7-12,15H,6,13-14,16H2,1-5H3/p+1