1,3-benzodioxol-5-ylmethyl-[(3,5-dimethyl-4-oxidanyl-phenyl)methyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[(3,5-dimethyl-4-oxidanyl-phenyl)methyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[(4-hydroxy-3,5-dimethyl-phenyl)methyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[(4-hydroxy-3,5-dimethylphenyl)methyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[(4-hydroxy-3,5-dimethylphenyl)methyl]azanium Traditional Name: (4-hydroxy-3,5-dimethyl-benzyl)-piperonyl-ammonium Formula: C17H20NO3+ MolecularWeight: 286.3456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)C[NH2+]CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC(=CC(=C1O)C)C[NH2+]CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H19NO3/c1-11-5-14(6-12(2)17(11)19)9-18-8-13-3-4-15-16(7-13)21-10-20-15/h3-7,18-19H,8-10H2,1-2H3/p+1