2-acetamidoethyl-[[2-[(3-fluorophenyl)methoxy]-6-methyl-quinolin-3-yl]methyl]azanium

Systemtic Name: 2-acetamidoethyl-[[2-[(3-fluorophenyl)methoxy]-6-methyl-quinolin-3-yl]methyl]azanium Openeye Name: 2-acetamidoethyl-[[2-[(3-fluorophenyl)methoxy]-6-methyl-3-quinolyl]methyl]ammonium CAS Name: 2-acetamidoethyl-[[2-[(3-fluorophenyl)methoxy]-6-methyl-3-quinolinyl]methyl]ammonium IUPAC Name: 2-acetamidoethyl-[[2-[(3-fluorophenyl)methoxy]-6-methylquinolin-3-yl]methyl]azanium Traditional Name: 2-acetamidoethyl-[[2-(3-fluorobenzyl)oxy-6-methyl-3-quinolyl]methyl]ammonium Formula: C22H25FN3O2+ MolecularWeight: 382.451203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(N=C2C=C1)OCC3=CC(=CC=C3)F)C[NH2+]CCNC(=O)C

Isomeric SMILES

CC1=CC2=CC(=C(N=C2C=C1)OCC3=CC(=CC=C3)F)C[NH2+]CCNC(=O)C

InChI

InChI=1S/C22H24FN3O2/c1-15-6-7-21-18(10-15)12-19(13-24-8-9-25-16(2)27)22(26-21)28-14-17-4-3-5-20(23)11-17/h3-7,10-12,24H,8-9,13-14H2,1-2H3,(H,25,27)/p+1