2-(1-imidazol-1-yl-3-oxidanylidene-butan-2-yl)isoindole-1,3-dione

Systemtic Name: 2-(1-imidazol-1-yl-3-oxidanylidene-butan-2-yl)isoindole-1,3-dione Openeye Name: 2-[1-(imidazol-1-ylmethyl)-2-oxo-propyl]isoindoline-1,3-dione CAS Name: 2-[1-(1-imidazolyl)-3-oxobutan-2-yl]isoindole-1,3-dione IUPAC Name: 2-(1-imidazol-1-yl-3-oxobutan-2-yl)isoindole-1,3-dione Traditional Name: 2-[1-(imidazol-1-ylmethyl)-2-keto-propyl]isoindoline-1,3-quinone Formula: C15H13N3O3 MolecularWeight: 283.28202

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CN1C=CN=C1)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(=O)C(CN1C=CN=C1)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C15H13N3O3/c1-10(19)13(8-17-7-6-16-9-17)18-14(20)11-4-2-3-5-12(11)15(18)21/h2-7,9,13H,8H2,1H3