cyclopropyl-[(4-fluorophenyl)methyl]-[(6-oxidanyl-1,3-benzodioxol-5-yl)methyl]azanium

Systemtic Name: cyclopropyl-[(4-fluorophenyl)methyl]-[(6-oxidanyl-1,3-benzodioxol-5-yl)methyl]azanium Openeye Name: cyclopropyl-[(4-fluorophenyl)methyl]-[(6-hydroxy-1,3-benzodioxol-5-yl)methyl]ammonium CAS Name: cyclopropyl-[(4-fluorophenyl)methyl]-[(6-hydroxy-1,3-benzodioxol-5-yl)methyl]ammonium IUPAC Name: cyclopropyl-[(4-fluorophenyl)methyl]-[(6-hydroxy-1,3-benzodioxol-5-yl)methyl]azanium Traditional Name: cyclopropyl-(4-fluorobenzyl)-[(6-hydroxy-1,3-benzodioxol-5-yl)methyl]ammonium Formula: C18H19FNO3+ MolecularWeight: 316.346763

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1[NH+](CC2=CC=C(C=C2)F)CC3=CC4=C(C=C3O)OCO4

Isomeric SMILES

C1CC1[NH+](CC2=CC=C(C=C2)F)CC3=CC4=C(C=C3O)OCO4

InChI

InChI=1S/C18H18FNO3/c19-14-3-1-12(2-4-14)9-20(15-5-6-15)10-13-7-17-18(8-16(13)21)23-11-22-17/h1-4,7-8,15,21H,5-6,9-11H2/p+1