5-(1,3-benzodioxol-5-yl)-1-methyl-N-(phenylmethyl)imidazol-2-amine; ethanedioic acid

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-1-methyl-N-(phenylmethyl)imidazol-2-amine; ethanedioic acid Openeye Name: 5-(1,3-benzodioxol-5-yl)-N-benzyl-1-methyl-imidazol-2-amine; oxalic acid CAS Name: 5-(1,3-benzodioxol-5-yl)-1-methyl-N-(phenylmethyl)-2-imidazolamine; oxalic acid IUPAC Name: 5-(1,3-benzodioxol-5-yl)-N-benzyl-1-methylimidazol-2-amine; oxalic acid Traditional Name: [5-(1,3-benzodioxol-5-yl)-1-methyl-imidazol-2-yl]-benzyl-amine; oxalic acid Formula: C20H19N3O6 MolecularWeight: 397.38136

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1NCC2=CC=CC=C2)C3=CC4=C(C=C3)OCO4.C(=O)(C(=O)O)O

Isomeric SMILES

CN1C(=CN=C1NCC2=CC=CC=C2)C3=CC4=C(C=C3)OCO4.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H17N3O2.C2H2O4/c1-21-15(14-7-8-16-17(9-14)23-12-22-16)11-20-18(21)19-10-13-5-3-2-4-6-13;3-1(4)2(5)6/h2-9,11H,10,12H2,1H3,(H,19,20);(H,3,4)(H,5,6)