(E)-3-[4-(5-tert-butyl-1,2,3-triazol-1-yl)phenyl]-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-[4-(5-tert-butyl-1,2,3-triazol-1-yl)phenyl]-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-[4-(5-tert-butyltriazol-1-yl)phenyl]-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-[4-(5-tert-butyl-1-triazolyl)phenyl]-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-[4-(5-tert-butyltriazol-1-yl)phenyl]-1-phenylprop-2-en-1-one Traditional Name: (E)-3-[4-(5-tert-butyltriazol-1-yl)phenyl]-1-phenyl-prop-2-en-1-one Formula: C21H21N3O MolecularWeight: 331.41094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CN=NN1C2=CC=C(C=C2)C=CC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CN=NN1C2=CC=C(C=C2)/C=C/C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O/c1-21(2,3)20-15-22-23-24(20)18-12-9-16(10-13-18)11-14-19(25)17-7-5-4-6-8-17/h4-15H,1-3H3/b14-11+