(E)-3-(benzotriazol-1-yl)-1-(4-methylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(benzotriazol-1-yl)-1-(4-methylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(benzotriazol-1-yl)-1-(p-tolyl)prop-2-en-1-one CAS Name: (E)-3-(1-benzotriazolyl)-1-(4-methylphenyl)-2-propen-1-one IUPAC Name: (E)-3-(benzotriazol-1-yl)-1-(4-methylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(benzotriazol-1-yl)-1-(p-tolyl)prop-2-en-1-one Formula: C16H13N3O MolecularWeight: 263.29392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C=CN2C3=CC=CC=C3N=N2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)/C=C/N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C16H13N3O/c1-12-6-8-13(9-7-12)16(20)10-11-19-15-5-3-2-4-14(15)17-18-19/h2-11H,1H3/b11-10+