2-(benzotriazol-1-ylmethyl)-3-oxidanylidene-1,3-diphenyl-prop-1-en-1-olate

Systemtic Name: 2-(benzotriazol-1-ylmethyl)-3-oxidanylidene-1,3-diphenyl-prop-1-en-1-olate Openeye Name: 2-(benzotriazol-1-ylmethyl)-3-oxo-1,3-diphenyl-prop-1-en-1-olate CAS Name: 2-(1-benzotriazolylmethyl)-3-oxo-1,3-diphenyl-1-propen-1-olate IUPAC Name: 2-(benzotriazol-1-ylmethyl)-3-oxo-1,3-diphenylprop-1-en-1-olate Traditional Name: 2-(benzotriazol-1-ylmethyl)-3-keto-1,3-diphenyl-prop-1-en-1-olate Formula: C22H16N3O2- MolecularWeight: 354.38134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=C(CN2C3=CC=CC=C3N=N2)C(=O)C4=CC=CC=C4)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=C(CN2C3=CC=CC=C3N=N2)C(=O)C4=CC=CC=C4)[O-]

InChI

InChI=1S/C22H17N3O2/c26-21(16-9-3-1-4-10-16)18(22(27)17-11-5-2-6-12-17)15-25-20-14-8-7-13-19(20)23-24-25/h1-14,26H,15H2/p-1