2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium

Systemtic Name: 2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Openeye Name: 2-[(1-phenyltetrazol-5-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium CAS Name: 2-[(1-phenyl-5-tetrazolyl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium IUPAC Name: 2-[(1-phenyltetrazol-5-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Traditional Name: 2-[(1-phenyltetrazol-5-yl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium Formula: C17H18N5+ MolecularWeight: 292.35832

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=CC=CC=C21)CC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CC2=CC=CC=C21)CC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C17H17N5/c1-2-8-16(9-3-1)22-17(18-19-20-22)13-21-11-10-14-6-4-5-7-15(14)12-21/h1-9H,10-13H2/p+1