(Z)-but-2-enedioic acid; 1-(pyridin-2-ylmethoxy)phthalazine

Systemtic Name: (Z)-but-2-enedioic acid; 1-(pyridin-2-ylmethoxy)phthalazine Openeye Name: maleic acid; 1-(2-pyridylmethoxy)phthalazine CAS Name: (Z)-2-butenedioic acid; 1-(2-pyridinylmethoxy)phthalazine IUPAC Name: (Z)-but-2-enedioic acid; 1-(pyridin-2-ylmethoxy)phthalazine Traditional Name: maleic acid; 1-(2-pyridylmethoxy)phthalazine Formula: C18H15N3O5 MolecularWeight: 353.3288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NN=C2OCC3=CC=CC=N3.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=NN=C2OCC3=CC=CC=N3.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C14H11N3O.C4H4O4/c1-2-7-13-11(5-1)9-16-17-14(13)18-10-12-6-3-4-8-15-12;5-3(6)1-2-4(7)8/h1-9H,10H2;1-2H,(H,5,6)(H,7,8)/b;2-1-