2-[5-(1,2,4-triazol-1-yl)pentyl]isoindole-1,3-dione hydrochloride

Systemtic Name: 2-[5-(1,2,4-triazol-1-yl)pentyl]isoindole-1,3-dione hydrochloride Openeye Name: 2-[5-(1,2,4-triazol-1-yl)pentyl]isoindoline-1,3-dione hydrochloride CAS Name: 2-[5-(1,2,4-triazol-1-yl)pentyl]isoindole-1,3-dione hydrochloride IUPAC Name: 2-[5-(1,2,4-triazol-1-yl)pentyl]isoindole-1,3-dione hydrochloride Traditional Name: 2-[5-(1,2,4-triazol-1-yl)pentyl]isoindoline-1,3-quinone hydrochloride Formula: C15H17ClN4O2 MolecularWeight: 320.77408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCN3C=NC=N3.Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCN3C=NC=N3.Cl

InChI

InChI=1S/C15H16N4O2.ClH/c20-14-12-6-2-3-7-13(12)15(21)19(14)9-5-1-4-8-18-11-16-10-17-18;/h2-3,6-7,10-11H,1,4-5,8-9H2;1H