4-(4-imidazol-1-ylbutyl)isoindole-1,3-dione

Systemtic Name: 4-(4-imidazol-1-ylbutyl)isoindole-1,3-dione Openeye Name: 4-(4-imidazol-1-ylbutyl)isoindoline-1,3-dione CAS Name: 4-[4-(1-imidazolyl)butyl]isoindole-1,3-dione IUPAC Name: 4-(4-imidazol-1-ylbutyl)isoindole-1,3-dione Traditional Name: 4-(4-imidazol-1-ylbutyl)isoindoline-1,3-quinone Formula: C15H15N3O2 MolecularWeight: 269.2985

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)CCCCN3C=CN=C3)C(=O)NC2=O

Isomeric SMILES

C1=CC2=C(C(=C1)CCCCN3C=CN=C3)C(=O)NC2=O

InChI

InChI=1S/C15H15N3O2/c19-14-12-6-3-5-11(13(12)15(20)17-14)4-1-2-8-18-9-7-16-10-18/h3,5-7,9-10H,1-2,4,8H2,(H,17,19,20)