4-(2-phenyl-1,3-dihydro-1,2,3-triazol-4-yl)cyclohexa-3,5-diene-1,2-dione

Systemtic Name: 4-(2-phenyl-1,3-dihydro-1,2,3-triazol-4-yl)cyclohexa-3,5-diene-1,2-dione Openeye Name: 4-(2-phenyl-1,3-dihydrotriazol-4-yl)-1,2-benzoquinone CAS Name: 4-(2-phenyl-1,3-dihydrotriazol-4-yl)cyclohexa-3,5-diene-1,2-dione IUPAC Name: 4-(2-phenyl-1,3-dihydrotriazol-4-yl)cyclohexa-3,5-diene-1,2-dione Traditional Name: 4-(2-phenyl-1,3-dihydrotriazol-4-yl)-o-benzoquinone Formula: C14H11N3O2 MolecularWeight: 253.25604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2NC=C(N2)C3=CC(=O)C(=O)C=C3

Isomeric SMILES

C1=CC=C(C=C1)N2NC=C(N2)C3=CC(=O)C(=O)C=C3

InChI

InChI=1S/C14H11N3O2/c18-13-7-6-10(8-14(13)19)12-9-15-17(16-12)11-4-2-1-3-5-11/h1-9,15-16H