1-[(3,4-dimethoxyphenyl)methylamino]propan-2-ol; ethanedioic acid

Systemtic Name: 1-[(3,4-dimethoxyphenyl)methylamino]propan-2-ol; ethanedioic acid Openeye Name: 1-[(3,4-dimethoxyphenyl)methylamino]propan-2-ol; oxalic acid CAS Name: 1-[(3,4-dimethoxyphenyl)methylamino]-2-propanol; oxalic acid IUPAC Name: 1-[(3,4-dimethoxyphenyl)methylamino]propan-2-ol; oxalic acid Traditional Name: oxalic acid; 1-(veratrylamino)propan-2-ol Formula: C14H21NO7 MolecularWeight: 315.31904

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNCC1=CC(=C(C=C1)OC)OC)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC(CNCC1=CC(=C(C=C1)OC)OC)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C12H19NO3.C2H2O4/c1-9(14)7-13-8-10-4-5-11(15-2)12(6-10)16-3;3-1(4)2(5)6/h4-6,9,13-14H,7-8H2,1-3H3;(H,3,4)(H,5,6)