(E)-3-(benzotriazol-1-yl)-2-methyl-3-phenyl-prop-2-enal

Systemtic Name: (E)-3-(benzotriazol-1-yl)-2-methyl-3-phenyl-prop-2-enal Openeye Name: (E)-3-(benzotriazol-1-yl)-2-methyl-3-phenyl-prop-2-enal CAS Name: (E)-3-(1-benzotriazolyl)-2-methyl-3-phenyl-2-propenal IUPAC Name: (E)-3-(benzotriazol-1-yl)-2-methyl-3-phenylprop-2-enal Traditional Name: (E)-3-(benzotriazol-1-yl)-2-methyl-3-phenyl-acrolein Formula: C16H13N3O MolecularWeight: 263.29392

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C1=CC=CC=C1)N2C3=CC=CC=C3N=N2)C=O

Isomeric SMILES

C/C(=C(/C1=CC=CC=C1)\N2C3=CC=CC=C3N=N2)/C=O

InChI

InChI=1S/C16H13N3O/c1-12(11-20)16(13-7-3-2-4-8-13)19-15-10-6-5-9-14(15)17-18-19/h2-11H,1H3/b16-12+