N-(1,3-benzodioxol-5-ylmethyl)-2-(2-methoxyphenyl)ethanamine; ethanedioic acid

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-methoxyphenyl)ethanamine; ethanedioic acid Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-methoxyphenyl)ethanamine; oxalic acid CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-methoxyphenyl)ethanamine; oxalic acid IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-methoxyphenyl)ethanamine; oxalic acid Traditional Name: 2-(2-methoxyphenyl)ethyl-piperonyl-amine; oxalic acid Formula: C19H21NO7 MolecularWeight: 375.37254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CCNCC2=CC3=C(C=C2)OCO3.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=CC=C1CCNCC2=CC3=C(C=C2)OCO3.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H19NO3.C2H2O4/c1-19-15-5-3-2-4-14(15)8-9-18-11-13-6-7-16-17(10-13)21-12-20-16;3-1(4)2(5)6/h2-7,10,18H,8-9,11-12H2,1H3;(H,3,4)(H,5,6)