2-(5-imidazol-1-ylpentyl)isoindole-1,3-dione hydrochloride

Systemtic Name: 2-(5-imidazol-1-ylpentyl)isoindole-1,3-dione hydrochloride Openeye Name: 2-(5-imidazol-1-ylpentyl)isoindoline-1,3-dione hydrochloride CAS Name: 2-[5-(1-imidazolyl)pentyl]isoindole-1,3-dione hydrochloride IUPAC Name: 2-(5-imidazol-1-ylpentyl)isoindole-1,3-dione hydrochloride Traditional Name: 2-(5-imidazol-1-ylpentyl)isoindoline-1,3-quinone hydrochloride Formula: C16H18ClN3O2 MolecularWeight: 319.78602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCN3C=CN=C3.Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCN3C=CN=C3.Cl

InChI

InChI=1S/C16H17N3O2.ClH/c20-15-13-6-2-3-7-14(13)16(21)19(15)10-5-1-4-9-18-11-8-17-12-18;/h2-3,6-8,11-12H,1,4-5,9-10H2;1H