(E)-1-(benzotriazol-1-yl)-2-methyl-pent-2-en-1-one

Systemtic Name: (E)-1-(benzotriazol-1-yl)-2-methyl-pent-2-en-1-one Openeye Name: (E)-1-(benzotriazol-1-yl)-2-methyl-pent-2-en-1-one CAS Name: (E)-1-(1-benzotriazolyl)-2-methyl-2-penten-1-one IUPAC Name: (E)-1-(benzotriazol-1-yl)-2-methylpent-2-en-1-one Traditional Name: (E)-1-(benzotriazol-1-yl)-2-methyl-pent-2-en-1-one Formula: C12H13N3O MolecularWeight: 215.25112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13N3O/c1-3-6-9(2)12(16)15-11-8-5-4-7-10(11)13-14-15/h4-8H,3H2,1-2H3/b9-6+