(E)-1,3-diphenyl-3-(1,2,4-triazol-1-yl)prop-2-en-1-one

Systemtic Name: (E)-1,3-diphenyl-3-(1,2,4-triazol-1-yl)prop-2-en-1-one Openeye Name: (E)-1,3-diphenyl-3-(1,2,4-triazol-1-yl)prop-2-en-1-one CAS Name: (E)-1,3-diphenyl-3-(1,2,4-triazol-1-yl)-2-propen-1-one IUPAC Name: (E)-1,3-diphenyl-3-(1,2,4-triazol-1-yl)prop-2-en-1-one Traditional Name: (E)-1,3-diphenyl-3-(1,2,4-triazol-1-yl)prop-2-en-1-one Formula: C17H13N3O MolecularWeight: 275.30462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=CC(=O)C2=CC=CC=C2)N3C=NC=N3

Isomeric SMILES

C1=CC=C(C=C1)/C(=C\C(=O)C2=CC=CC=C2)/N3C=NC=N3

InChI

InChI=1S/C17H13N3O/c21-17(15-9-5-2-6-10-15)11-16(20-13-18-12-19-20)14-7-3-1-4-8-14/h1-13H/b16-11+