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

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-N-[(2-chlorophenyl)methyl]methanamine; ethanedioic acid Openeye Name: 1-(1,3-benzodioxol-5-yl)-N-[(2-chlorophenyl)methyl]methanamine; oxalic acid CAS Name: 1-(1,3-benzodioxol-5-yl)-N-[(2-chlorophenyl)methyl]methanamine; oxalic acid IUPAC Name: 1-(1,3-benzodioxol-5-yl)-N-[(2-chlorophenyl)methyl]methanamine; oxalic acid Traditional Name: (2-chlorobenzyl)-piperonyl-amine; oxalic acid Formula: C17H16ClNO6 MolecularWeight: 365.76504

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNCC3=CC=CC=C3Cl.C(=O)(C(=O)O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNCC3=CC=CC=C3Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H14ClNO2.C2H2O4/c16-13-4-2-1-3-12(13)9-17-8-11-5-6-14-15(7-11)19-10-18-14;3-1(4)2(5)6/h1-7,17H,8-10H2;(H,3,4)(H,5,6)