N-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]-1-methoxy-propan-2-amine; ethanedioic acid

Systemtic Name: N-[(2-bromanyl-4,5-dimethoxy-phenyl)methyl]-1-methoxy-propan-2-amine; ethanedioic acid Openeye Name: N-[(2-bromo-4,5-dimethoxy-phenyl)methyl]-1-methoxy-propan-2-amine; oxalic acid CAS Name: N-[(2-bromo-4,5-dimethoxyphenyl)methyl]-1-methoxy-2-propanamine; oxalic acid IUPAC Name: N-[(2-bromo-4,5-dimethoxyphenyl)methyl]-1-methoxypropan-2-amine; oxalic acid Traditional Name: (2-bromo-4,5-dimethoxy-benzyl)-(2-methoxy-1-methyl-ethyl)amine; oxalic acid Formula: C15H22BrNO7 MolecularWeight: 408.24168

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NCC1=CC(=C(C=C1Br)OC)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CC(COC)NCC1=CC(=C(C=C1Br)OC)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H20BrNO3.C2H2O4/c1-9(8-16-2)15-7-10-5-12(17-3)13(18-4)6-11(10)14;3-1(4)2(5)6/h5-6,9,15H,7-8H2,1-4H3;(H,3,4)(H,5,6)