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

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[[3,4-bis(oxidanyl)phenyl]methyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[(3,4-dihydroxyphenyl)methyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[(3,4-dihydroxyphenyl)methyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[(3,4-dihydroxyphenyl)methyl]azanium Traditional Name: piperonyl(protocatechuyl)ammonium Formula: C15H16NO4+ MolecularWeight: 274.29184

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C[NH2+]CC3=CC(=C(C=C3)O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C[NH2+]CC3=CC(=C(C=C3)O)O

InChI

InChI=1S/C15H15NO4/c17-12-3-1-10(5-13(12)18)7-16-8-11-2-4-14-15(6-11)20-9-19-14/h1-6,16-18H,7-9H2/p+1