3-[1-(benzotriazol-1-yl)ethyl]pentane-2,4-dione

Systemtic Name: 3-[1-(benzotriazol-1-yl)ethyl]pentane-2,4-dione Openeye Name: 3-[1-(benzotriazol-1-yl)ethyl]pentane-2,4-dione CAS Name: 3-[1-(1-benzotriazolyl)ethyl]pentane-2,4-dione IUPAC Name: 3-[1-(benzotriazol-1-yl)ethyl]pentane-2,4-dione Traditional Name: 3-[1-(benzotriazol-1-yl)ethyl]pentane-2,4-dione Formula: C13H15N3O2 MolecularWeight: 245.2771

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)C)C(=O)C)N1C2=CC=CC=C2N=N1

Isomeric SMILES

CC(C(C(=O)C)C(=O)C)N1C2=CC=CC=C2N=N1

InChI

InChI=1S/C13H15N3O2/c1-8(13(9(2)17)10(3)18)16-12-7-5-4-6-11(12)14-15-16/h4-8,13H,1-3H3