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

Systemtic Name: [2-(2-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl-(isoquinolin-5-ylmethyl)-methyl-azanium Openeye Name: [2-(2-chlorophenyl)-5-methyl-oxazol-4-yl]methyl-(5-isoquinolylmethyl)-methyl-ammonium CAS Name: [2-(2-chlorophenyl)-5-methyl-4-oxazolyl]methyl-(5-isoquinolinylmethyl)-methylammonium IUPAC Name: [2-(2-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl-(isoquinolin-5-ylmethyl)-methylazanium Traditional Name: [2-(2-chlorophenyl)-5-methyl-oxazol-4-yl]methyl-(5-isoquinolylmethyl)-methyl-ammonium Formula: C22H21ClN3O+ MolecularWeight: 378.87464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2Cl)C[NH+](C)CC3=CC=CC4=C3C=CN=C4

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2Cl)C[NH+](C)CC3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C22H20ClN3O/c1-15-21(25-22(27-15)19-8-3-4-9-20(19)23)14-26(2)13-17-7-5-6-16-12-24-11-10-18(16)17/h3-12H,13-14H2,1-2H3/p+1