6,7-dimethoxy-N-(1H-1,2,4-triazol-4-ium-4-yl)spiro[4H-isoquinoline-3,1'-cyclopentane]-1-amine

Systemtic Name: 6,7-dimethoxy-N-(1H-1,2,4-triazol-4-ium-4-yl)spiro[4H-isoquinoline-3,1'-cyclopentane]-1-amine Openeye Name: 6,7-dimethoxy-N-(1H-1,2,4-triazol-4-ium-4-yl)spiro[4H-isoquinoline-3,1'-cyclopentane]-1-amine CAS Name: 6,7-dimethoxy-N-(1H-1,2,4-triazol-4-ium-4-yl)-1-spiro[4H-isoquinoline-3,1'-cyclopentane]amine IUPAC Name: 6,7-dimethoxy-N-(1H-1,2,4-triazol-4-ium-4-yl)spiro[4H-isoquinoline-3,1'-cyclopentane]-1-amine Traditional Name: (6,7-dimethoxyspiro[4H-isoquinoline-3,1'-cyclopentane]-1-yl)-(1H-1,2,4-triazol-4-ium-4-yl)amine Formula: C17H22N5O2+ MolecularWeight: 328.38888

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC3(CCCC3)N=C2N[N+]4=CNN=C4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CC3(CCCC3)N=C2N[N+]4=CNN=C4)OC

InChI

InChI=1S/C17H21N5O2/c1-23-14-7-12-9-17(5-3-4-6-17)20-16(13(12)8-15(14)24-2)21-22-10-18-19-11-22/h7-8,10-11H,3-6,9H2,1-2H3,(H,20,21)/p+1