(7-chloranyl-2-phenethyloxy-quinolin-3-yl)methyl-methyl-(1,2-oxazol-3-ylmethyl)azanium

Systemtic Name: (7-chloranyl-2-phenethyloxy-quinolin-3-yl)methyl-methyl-(1,2-oxazol-3-ylmethyl)azanium Openeye Name: (7-chloro-2-phenethyloxy-3-quinolyl)methyl-(isoxazol-3-ylmethyl)-methyl-ammonium CAS Name: (7-chloro-2-phenethyloxy-3-quinolinyl)methyl-(3-isoxazolylmethyl)-methylammonium IUPAC Name: (7-chloro-2-phenethyloxyquinolin-3-yl)methyl-methyl-(1,2-oxazol-3-ylmethyl)azanium Traditional Name: (7-chloro-2-phenethyloxy-3-quinolyl)methyl-(isoxazol-3-ylmethyl)-methyl-ammonium Formula: C23H23ClN3O2+ MolecularWeight: 408.90062

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NOC=C1)CC2=C(N=C3C=C(C=CC3=C2)Cl)OCCC4=CC=CC=C4

Isomeric SMILES

C[NH+](CC1=NOC=C1)CC2=C(N=C3C=C(C=CC3=C2)Cl)OCCC4=CC=CC=C4

InChI

InChI=1S/C23H22ClN3O2/c1-27(16-21-10-12-29-26-21)15-19-13-18-7-8-20(24)14-22(18)25-23(19)28-11-9-17-5-3-2-4-6-17/h2-8,10,12-14H,9,11,15-16H2,1H3/p+1