1,3-benzodioxol-5-ylmethyl-(2-methyl-2-oxidanyl-propyl)azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-(2-methyl-2-oxidanyl-propyl)azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-(2-hydroxy-2-methyl-propyl)ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-(2-hydroxy-2-methylpropyl)ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-(2-hydroxy-2-methylpropyl)azanium Traditional Name: (2-hydroxy-2-methyl-propyl)-piperonyl-ammonium Formula: C12H18NO3+ MolecularWeight: 224.27622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C[NH2+]CC1=CC2=C(C=C1)OCO2)O

Isomeric SMILES

CC(C)(C[NH2+]CC1=CC2=C(C=C1)OCO2)O

InChI

InChI=1S/C12H17NO3/c1-12(2,14)7-13-6-9-3-4-10-11(5-9)16-8-15-10/h3-5,13-14H,6-8H2,1-2H3/p+1