1,3-benzodioxol-5-ylmethyl-(4-tert-butylcyclohexyl)azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-(4-tert-butylcyclohexyl)azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-(4-tert-butylcyclohexyl)ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-(4-tert-butylcyclohexyl)ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-(4-tert-butylcyclohexyl)azanium Traditional Name: (4-tert-butylcyclohexyl)-piperonyl-ammonium Formula: C18H28NO2+ MolecularWeight: 290.42042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)[NH2+]CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)(C)C1CCC(CC1)[NH2+]CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H27NO2/c1-18(2,3)14-5-7-15(8-6-14)19-11-13-4-9-16-17(10-13)21-12-20-16/h4,9-10,14-15,19H,5-8,11-12H2,1-3H3/p+1