2-[C-phenyl-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indene-1,3-dione

Systemtic Name: 2-[C-phenyl-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indene-1,3-dione Openeye Name: 2-[C-phenyl-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indane-1,3-dione CAS Name: 2-[phenyl(1H-1,2,4-triazol-5-ylimino)methyl]indene-1,3-dione IUPAC Name: 2-[C-phenyl-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indene-1,3-dione Traditional Name: 2-[C-phenyl-N-(1H-1,2,4-triazol-5-yl)carbonimidoyl]indane-1,3-quinone Formula: C18H12N4O2 MolecularWeight: 316.31348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=NC2=NC=NN2)C3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)C(=NC2=NC=NN2)C3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C18H12N4O2/c23-16-12-8-4-5-9-13(12)17(24)14(16)15(11-6-2-1-3-7-11)21-18-19-10-20-22-18/h1-10,14H,(H,19,20,22)