2-[(4-pyrazol-1-ylphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 2-[(4-pyrazol-1-ylphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 2-[(4-pyrazol-1-ylphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 2-[[4-(1-pyrazolyl)phenyl]methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 2-[(4-pyrazol-1-ylphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 2-(4-pyrazol-1-ylbenzyl)-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C19H20N3+ MolecularWeight: 290.3822

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=CC=CC=C21)CC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

C1C[NH+](CC2=CC=CC=C21)CC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C19H19N3/c1-2-5-18-15-21(13-10-17(18)4-1)14-16-6-8-19(9-7-16)22-12-3-11-20-22/h1-9,11-12H,10,13-15H2/p+1