2-(3-imidazol-1-yl-2-oxidanyl-propyl)isoindole-1,3-dione

Systemtic Name: 2-(3-imidazol-1-yl-2-oxidanyl-propyl)isoindole-1,3-dione Openeye Name: 2-(2-hydroxy-3-imidazol-1-yl-propyl)isoindoline-1,3-dione CAS Name: 2-[2-hydroxy-3-(1-imidazolyl)propyl]isoindole-1,3-dione IUPAC Name: 2-(2-hydroxy-3-imidazol-1-ylpropyl)isoindole-1,3-dione Traditional Name: 2-(2-hydroxy-3-imidazol-1-yl-propyl)isoindoline-1,3-quinone Formula: C14H13N3O3 MolecularWeight: 271.27132

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CC(CN3C=CN=C3)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CC(CN3C=CN=C3)O

InChI

InChI=1S/C14H13N3O3/c18-10(7-16-6-5-15-9-16)8-17-13(19)11-3-1-2-4-12(11)14(17)20/h1-6,9-10,18H,7-8H2