ethanedioic acid; 1-imidazol-1-yl-3-phenoxy-propan-2-ol

Systemtic Name: ethanedioic acid; 1-imidazol-1-yl-3-phenoxy-propan-2-ol Openeye Name: 1-imidazol-1-yl-3-phenoxy-propan-2-ol; oxalic acid CAS Name: 1-(1-imidazolyl)-3-phenoxy-2-propanol; oxalic acid IUPAC Name: 1-imidazol-1-yl-3-phenoxypropan-2-ol; oxalic acid Traditional Name: 1-imidazol-1-yl-3-phenoxy-propan-2-ol; oxalic acid Formula: C14H16N2O6 MolecularWeight: 308.28664

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(CN2C=CN=C2)O.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)OCC(CN2C=CN=C2)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C12H14N2O2.C2H2O4/c15-11(8-14-7-6-13-10-14)9-16-12-4-2-1-3-5-12;3-1(4)2(5)6/h1-7,10-11,15H,8-9H2;(H,3,4)(H,5,6)