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

Systemtic Name: 2-[4-(benzotriazol-1-yl)-4-oxidanylidene-butyl]isoindole-1,3-dione Openeye Name: 2-[4-(benzotriazol-1-yl)-4-oxo-butyl]isoindoline-1,3-dione CAS Name: 2-[4-(1-benzotriazolyl)-4-oxobutyl]isoindole-1,3-dione IUPAC Name: 2-[4-(benzotriazol-1-yl)-4-oxobutyl]isoindole-1,3-dione Traditional Name: 2-[4-(benzotriazol-1-yl)-4-keto-butyl]isoindoline-1,3-quinone Formula: C18H14N4O3 MolecularWeight: 334.32876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)N3C4=CC=CC=C4N=N3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C18H14N4O3/c23-16(22-15-9-4-3-8-14(15)19-20-22)10-5-11-21-17(24)12-6-1-2-7-13(12)18(21)25/h1-4,6-9H,5,10-11H2