4-(4-chlorophenyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1,2-oxazol-5-amine

Systemtic Name: 4-(4-chlorophenyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1,2-oxazol-5-amine Openeye Name: 4-(4-chlorophenyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)isoxazol-5-amine CAS Name: 4-(4-chlorophenyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-5-isoxazolamine IUPAC Name: 4-(4-chlorophenyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1,2-oxazol-5-amine Traditional Name: [4-(4-chlorophenyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)isoxazol-5-yl]amine Formula: C19H19ClN3O+ MolecularWeight: 340.82666

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=CC=CC=C21)CC3=NOC(=C3C4=CC=C(C=C4)Cl)N

Isomeric SMILES

C1C[NH+](CC2=CC=CC=C21)CC3=NOC(=C3C4=CC=C(C=C4)Cl)N

InChI

InChI=1S/C19H18ClN3O/c20-16-7-5-14(6-8-16)18-17(22-24-19(18)21)12-23-10-9-13-3-1-2-4-15(13)11-23/h1-8H,9-12,21H2/p+1