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

Systemtic Name: (E)-3-phenyl-1-(1,2,4-triazol-1-yl)prop-2-en-1-one Openeye Name: (E)-3-phenyl-1-(1,2,4-triazol-1-yl)prop-2-en-1-one CAS Name: (E)-3-phenyl-1-(1,2,4-triazol-1-yl)-2-propen-1-one IUPAC Name: (E)-3-phenyl-1-(1,2,4-triazol-1-yl)prop-2-en-1-one Traditional Name: (E)-3-phenyl-1-(1,2,4-triazol-1-yl)prop-2-en-1-one Formula: C11H9N3O MolecularWeight: 199.20866

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)N2C=NC=N2

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=O)N2C=NC=N2

InChI

InChI=1S/C11H9N3O/c15-11(14-9-12-8-13-14)7-6-10-4-2-1-3-5-10/h1-9H/b7-6+