(6E)-6-(1,2-dihydrobenzotriazol-4-ylidene)-4-methyl-cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-(1,2-dihydrobenzotriazol-4-ylidene)-4-methyl-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-(1,2-dihydrobenzotriazol-4-ylidene)-4-methyl-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-(1,2-dihydrobenzotriazol-4-ylidene)-4-methyl-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-(1,2-dihydrobenzotriazol-4-ylidene)-4-methylcyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-(1,2-dihydrobenzotriazol-4-ylidene)-4-methyl-cyclohexa-2,4-dien-1-one Formula: C13H11N3O MolecularWeight: 225.24594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=CC=C3C2=NNN3)C(=O)C=C1

Isomeric SMILES

CC1=C/C(=C\2/C=CC=C3C2=NNN3)/C(=O)C=C1

InChI

InChI=1S/C13H11N3O/c1-8-5-6-12(17)10(7-8)9-3-2-4-11-13(9)15-16-14-11/h2-7,14,16H,1H3/b10-9+