4-(4-phenyl-1H-1,2,4-triazol-5-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: 4-(4-phenyl-1H-1,2,4-triazol-5-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: 4-(4-phenyl-1H-1,2,4-triazol-5-ylidene)cyclohexa-2,5-dien-1-one CAS Name: 4-(4-phenyl-1H-1,2,4-triazol-5-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: 4-(4-phenyl-1H-1,2,4-triazol-5-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: 4-(4-phenyl-1H-1,2,4-triazol-5-ylidene)cyclohexa-2,5-dien-1-one Formula: C14H11N3O MolecularWeight: 237.25664

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=NNC2=C3C=CC(=O)C=C3

Isomeric SMILES

C1=CC=C(C=C1)N2C=NNC2=C3C=CC(=O)C=C3

InChI

InChI=1S/C14H11N3O/c18-13-8-6-11(7-9-13)14-16-15-10-17(14)12-4-2-1-3-5-12/h1-10,16H