2-[4-(1,2,3,4-tetrazol-2-yl)butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-(1,2,3,4-tetrazol-2-yl)butyl]isoindole-1,3-dione Openeye Name: 2-[4-(tetrazol-2-yl)butyl]isoindoline-1,3-dione CAS Name: 2-[4-(2-tetrazolyl)butyl]isoindole-1,3-dione IUPAC Name: 2-[4-(tetrazol-2-yl)butyl]isoindole-1,3-dione Traditional Name: 2-[4-(tetrazol-2-yl)butyl]isoindoline-1,3-quinone Formula: C13H13N5O2 MolecularWeight: 271.27462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCN3N=CN=N3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCN3N=CN=N3

InChI

InChI=1S/C13H13N5O2/c19-12-10-5-1-2-6-11(10)13(20)17(12)7-3-4-8-18-15-9-14-16-18/h1-2,5-6,9H,3-4,7-8H2