1-(1,3-benzodioxol-5-yl)-N-[(2,4-dimethylphenyl)methyl]methanamine; ethanedioic acid

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-N-[(2,4-dimethylphenyl)methyl]methanamine; ethanedioic acid Openeye Name: 1-(1,3-benzodioxol-5-yl)-N-[(2,4-dimethylphenyl)methyl]methanamine; oxalic acid CAS Name: 1-(1,3-benzodioxol-5-yl)-N-[(2,4-dimethylphenyl)methyl]methanamine; oxalic acid IUPAC Name: 1-(1,3-benzodioxol-5-yl)-N-[(2,4-dimethylphenyl)methyl]methanamine; oxalic acid Traditional Name: (2,4-dimethylbenzyl)-piperonyl-amine; oxalic acid Formula: C19H21NO6 MolecularWeight: 359.37314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CNCC2=CC3=C(C=C2)OCO3)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C=C1)CNCC2=CC3=C(C=C2)OCO3)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H19NO2.C2H2O4/c1-12-3-5-15(13(2)7-12)10-18-9-14-4-6-16-17(8-14)20-11-19-16;3-1(4)2(5)6/h3-8,18H,9-11H2,1-2H3;(H,3,4)(H,5,6)