(E,1S,2S)-1-(benzotriazol-1-yl)-1-(4-methylphenyl)-2,4-diphenyl-but-3-en-2-ol

Systemtic Name: (E,1S,2S)-1-(benzotriazol-1-yl)-1-(4-methylphenyl)-2,4-diphenyl-but-3-en-2-ol Openeye Name: (E,1S,2S)-1-(benzotriazol-1-yl)-2,4-diphenyl-1-(p-tolyl)but-3-en-2-ol CAS Name: (E,1S,2S)-1-(1-benzotriazolyl)-1-(4-methylphenyl)-2,4-diphenyl-3-buten-2-ol IUPAC Name: (E,1S,2S)-1-(benzotriazol-1-yl)-1-(4-methylphenyl)-2,4-diphenylbut-3-en-2-ol Traditional Name: (E,1S,2S)-1-(benzotriazol-1-yl)-2,4-diphenyl-1-(p-tolyl)but-3-en-2-ol Formula: C29H25N3O MolecularWeight: 431.5283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(C=CC2=CC=CC=C2)(C3=CC=CC=C3)O)N4C5=CC=CC=C5N=N4

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H]([C@](/C=C/C2=CC=CC=C2)(C3=CC=CC=C3)O)N4C5=CC=CC=C5N=N4

InChI

InChI=1S/C29H25N3O/c1-22-16-18-24(19-17-22)28(32-27-15-9-8-14-26(27)30-31-32)29(33,25-12-6-3-7-13-25)21-20-23-10-4-2-5-11-23/h2-21,28,33H,1H3/b21-20+/t28-,29-/m0/s1