(3-ethoxycarbonyl-4-methyl-quinolin-2-yl)methyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]-methyl-azanium

Systemtic Name: (3-ethoxycarbonyl-4-methyl-quinolin-2-yl)methyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]-methyl-azanium Openeye Name: (3-ethoxycarbonyl-4-methyl-2-quinolyl)methyl-[(3-fluoro-4-methoxy-phenyl)methyl]-methyl-ammonium CAS Name: (3-ethoxycarbonyl-4-methyl-2-quinolinyl)methyl-[(3-fluoro-4-methoxyphenyl)methyl]-methylammonium IUPAC Name: (3-ethoxycarbonyl-4-methylquinolin-2-yl)methyl-[(3-fluoro-4-methoxyphenyl)methyl]-methylazanium Traditional Name: (3-carbethoxy-4-methyl-2-quinolyl)methyl-(3-fluoro-4-methoxy-benzyl)-methyl-ammonium Formula: C23H26FN2O3+ MolecularWeight: 397.462543

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1C[NH+](C)CC3=CC(=C(C=C3)OC)F)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1C[NH+](C)CC3=CC(=C(C=C3)OC)F)C

InChI

InChI=1S/C23H25FN2O3/c1-5-29-23(27)22-15(2)17-8-6-7-9-19(17)25-20(22)14-26(3)13-16-10-11-21(28-4)18(24)12-16/h6-12H,5,13-14H2,1-4H3/p+1