(Z)-but-2-enedioic acid; 4-[3-(1H-imidazol-5-yl)propoxy]phenol

Systemtic Name: (Z)-but-2-enedioic acid; 4-[3-(1H-imidazol-5-yl)propoxy]phenol Openeye Name: 4-[3-(1H-imidazol-5-yl)propoxy]phenol; maleic acid CAS Name: (Z)-2-butenedioic acid; 4-[3-(1H-imidazol-5-yl)propoxy]phenol IUPAC Name: (Z)-but-2-enedioic acid; 4-[3-(1H-imidazol-5-yl)propoxy]phenol Traditional Name: 4-[3-(1H-imidazol-5-yl)propoxy]phenol; maleic acid Formula: C16H18N2O6 MolecularWeight: 334.32392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1O)OCCCC2=CN=CN2.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1O)OCCCC2=CN=CN2.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C12H14N2O2.C4H4O4/c15-11-3-5-12(6-4-11)16-7-1-2-10-8-13-9-14-10;5-3(6)1-2-4(7)8/h3-6,8-9,15H,1-2,7H2,(H,13,14);1-2H,(H,5,6)(H,7,8)/b;2-1-