3-(2-methoxyphenyl)-5-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1,2-oxazole

Systemtic Name: 3-(2-methoxyphenyl)-5-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1,2-oxazole Openeye Name: 3-(2-methoxyphenyl)-5-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)isoxazole CAS Name: 3-(2-methoxyphenyl)-5-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)isoxazole IUPAC Name: 3-(2-methoxyphenyl)-5-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1,2-oxazole Traditional Name: 3-(2-methoxyphenyl)-5-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)isoxazole Formula: C20H21N2O2+ MolecularWeight: 321.39294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NOC(=C2)C[NH+]3CCC4=CC=CC=C4C3

Isomeric SMILES

COC1=CC=CC=C1C2=NOC(=C2)C[NH+]3CCC4=CC=CC=C4C3

InChI

InChI=1S/C20H20N2O2/c1-23-20-9-5-4-8-18(20)19-12-17(24-21-19)14-22-11-10-15-6-2-3-7-16(15)13-22/h2-9,12H,10-11,13-14H2,1H3/p+1