4-[1,3-benzodioxol-5-ylmethyl(methyl)amino]benzoic acid

Systemtic Name: 4-[1,3-benzodioxol-5-ylmethyl(methyl)amino]benzoic acid Openeye Name: 4-[1,3-benzodioxol-5-ylmethyl(methyl)amino]benzoic acid CAS Name: 4-[1,3-benzodioxol-5-ylmethyl(methyl)amino]benzoic acid IUPAC Name: 4-[1,3-benzodioxol-5-ylmethyl(methyl)amino]benzoic acid Traditional Name: 4-[methyl(piperonyl)amino]benzoic acid Formula: C16H15NO4 MolecularWeight: 285.2946

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCO2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCO2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H15NO4/c1-17(13-5-3-12(4-6-13)16(18)19)9-11-2-7-14-15(8-11)21-10-20-14/h2-8H,9-10H2,1H3,(H,18,19)