[2-(3-fluorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl-(isoquinolin-5-ylmethyl)-methyl-azanium

Systemtic Name: [2-(3-fluorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl-(isoquinolin-5-ylmethyl)-methyl-azanium Openeye Name: [2-(3-fluorophenyl)-5-methyl-oxazol-4-yl]methyl-(5-isoquinolylmethyl)-methyl-ammonium CAS Name: [2-(3-fluorophenyl)-5-methyl-4-oxazolyl]methyl-(5-isoquinolinylmethyl)-methylammonium IUPAC Name: [2-(3-fluorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl-(isoquinolin-5-ylmethyl)-methylazanium Traditional Name: [2-(3-fluorophenyl)-5-methyl-oxazol-4-yl]methyl-(5-isoquinolylmethyl)-methyl-ammonium Formula: C22H21FN3O+ MolecularWeight: 362.420043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC(=CC=C2)F)C[NH+](C)CC3=CC=CC4=C3C=CN=C4

Isomeric SMILES

CC1=C(N=C(O1)C2=CC(=CC=C2)F)C[NH+](C)CC3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C22H20FN3O/c1-15-21(25-22(27-15)16-5-4-8-19(23)11-16)14-26(2)13-18-7-3-6-17-12-24-10-9-20(17)18/h3-12H,13-14H2,1-2H3/p+1