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

Systemtic Name: 4-(4-methoxyphenyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1,2-oxazol-5-amine Openeye Name: 4-(4-methoxyphenyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)isoxazol-5-amine CAS Name: 4-(4-methoxyphenyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-5-isoxazolamine IUPAC Name: 4-(4-methoxyphenyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1,2-oxazol-5-amine Traditional Name: [4-(4-methoxyphenyl)-3-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)isoxazol-5-yl]amine Formula: C20H22N3O2+ MolecularWeight: 336.40758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(ON=C2C[NH+]3CCC4=CC=CC=C4C3)N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(ON=C2C[NH+]3CCC4=CC=CC=C4C3)N

InChI

InChI=1S/C20H21N3O2/c1-24-17-8-6-15(7-9-17)19-18(22-25-20(19)21)13-23-11-10-14-4-2-3-5-16(14)12-23/h2-9H,10-13,21H2,1H3/p+1