1-(1,3-benzodioxol-5-yl)-N-(pyridin-2-ylmethyl)methanamine; ethanedioic acid

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-N-(pyridin-2-ylmethyl)methanamine; ethanedioic acid Openeye Name: 1-(1,3-benzodioxol-5-yl)-N-(2-pyridylmethyl)methanamine; oxalic acid CAS Name: 1-(1,3-benzodioxol-5-yl)-N-(2-pyridinylmethyl)methanamine; oxalic acid IUPAC Name: 1-(1,3-benzodioxol-5-yl)-N-(pyridin-2-ylmethyl)methanamine; oxalic acid Traditional Name: oxalic acid; piperonyl(2-pyridylmethyl)amine Formula: C16H16N2O6 MolecularWeight: 332.30804

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNCC3=CC=CC=N3.C(=O)(C(=O)O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNCC3=CC=CC=N3.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H14N2O2.C2H2O4/c1-2-6-16-12(3-1)9-15-8-11-4-5-13-14(7-11)18-10-17-13;3-1(4)2(5)6/h1-7,15H,8-10H2;(H,3,4)(H,5,6)