4-phenethylspiro[1,4-diazinan-1-ium-1,2'-3,4-dihydro-1H-isoquinolin-2-ium]

Systemtic Name: 4-phenethylspiro[1,4-diazinan-1-ium-1,2'-3,4-dihydro-1H-isoquinolin-2-ium] Openeye Name: 4-phenethylspiro[1,4-diazinan-1-ium-1,2'-3,4-dihydro-1H-isoquinolin-2-ium] CAS Name: 4-phenethylspiro[1,4-diazinan-1-ium-1,2'-3,4-dihydro-1H-isoquinolin-2-ium] IUPAC Name: 4-phenethylspiro[1,4-diazinan-1-ium-1,2'-3,4-dihydro-1H-isoquinolin-2-ium] Traditional Name: 4-phenethylspiro[1,4-diazinan-1-ium-1,2'-3,4-dihydro-1H-isoquinolin-2-ium] Formula: C21H27N2+ MolecularWeight: 307.45248

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+]2(CCN(CC2)CCC3=CC=CC=C3)CC4=CC=CC=C41

Isomeric SMILES

C1C[N+]2(CCN(CC2)CCC3=CC=CC=C3)CC4=CC=CC=C41

InChI

InChI=1S/C21H27N2/c1-2-6-19(7-3-1)10-12-22-13-16-23(17-14-22)15-11-20-8-4-5-9-21(20)18-23/h1-9H,10-18H2/q+1