2-(1,3-benzodioxol-5-yl)ethyl-(4-phenylcyclohexyl)azanium

Systemtic Name: 2-(1,3-benzodioxol-5-yl)ethyl-(4-phenylcyclohexyl)azanium Openeye Name: 2-(1,3-benzodioxol-5-yl)ethyl-(4-phenylcyclohexyl)ammonium CAS Name: 2-(1,3-benzodioxol-5-yl)ethyl-(4-phenylcyclohexyl)ammonium IUPAC Name: 2-(1,3-benzodioxol-5-yl)ethyl-(4-phenylcyclohexyl)azanium Traditional Name: homopiperonyl-(4-phenylcyclohexyl)ammonium Formula: C21H26NO2+ MolecularWeight: 324.43664

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C2=CC=CC=C2)[NH2+]CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CC(CCC1C2=CC=CC=C2)[NH2+]CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H25NO2/c1-2-4-17(5-3-1)18-7-9-19(10-8-18)22-13-12-16-6-11-20-21(14-16)24-15-23-20/h1-6,11,14,18-19,22H,7-10,12-13,15H2/p+1