(3Z)-2-ethanoyl-3-(1,2,4-triazol-4-ylimino)inden-1-one

Systemtic Name: (3Z)-2-ethanoyl-3-(1,2,4-triazol-4-ylimino)inden-1-one Openeye Name: (3Z)-2-acetyl-3-(1,2,4-triazol-4-ylimino)indan-1-one CAS Name: (3Z)-2-acetyl-3-(1,2,4-triazol-4-ylimino)-1-indenone IUPAC Name: (3Z)-2-acetyl-3-(1,2,4-triazol-4-ylimino)inden-1-one Traditional Name: (3Z)-2-acetyl-3-(1,2,4-triazol-4-ylimino)indan-1-one Formula: C13H10N4O2 MolecularWeight: 254.2441

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(=NN2C=NN=C2)C3=CC=CC=C3C1=O

Isomeric SMILES

CC(=O)C1/C(=N/N2C=NN=C2)/C3=CC=CC=C3C1=O

InChI

InChI=1S/C13H10N4O2/c1-8(18)11-12(16-17-6-14-15-7-17)9-4-2-3-5-10(9)13(11)19/h2-7,11H,1H3/b16-12+