1-(benzotriazol-1-yl)-3-methyl-but-2-en-1-one

Systemtic Name: 1-(benzotriazol-1-yl)-3-methyl-but-2-en-1-one Openeye Name: 1-(benzotriazol-1-yl)-3-methyl-but-2-en-1-one CAS Name: 1-(1-benzotriazolyl)-3-methyl-2-buten-1-one IUPAC Name: 1-(benzotriazol-1-yl)-3-methylbut-2-en-1-one Traditional Name: 1-(benzotriazol-1-yl)-3-methyl-but-2-en-1-one Formula: C11H11N3O MolecularWeight: 201.22454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11N3O/c1-8(2)7-11(15)14-10-6-4-3-5-9(10)12-13-14/h3-7H,1-2H3