(E,1R,2R)-1-(benzotriazol-1-yl)-1-(4-chlorophenyl)-4-phenyl-but-3-en-2-ol

Systemtic Name: (E,1R,2R)-1-(benzotriazol-1-yl)-1-(4-chlorophenyl)-4-phenyl-but-3-en-2-ol Openeye Name: (E,1R,2R)-1-(benzotriazol-1-yl)-1-(4-chlorophenyl)-4-phenyl-but-3-en-2-ol CAS Name: (E,1R,2R)-1-(1-benzotriazolyl)-1-(4-chlorophenyl)-4-phenyl-3-buten-2-ol IUPAC Name: (E,1R,2R)-1-(benzotriazol-1-yl)-1-(4-chlorophenyl)-4-phenylbut-3-en-2-ol Traditional Name: (E,1R,2R)-1-(benzotriazol-1-yl)-1-(4-chlorophenyl)-4-phenyl-but-3-en-2-ol Formula: C22H18ClN3O MolecularWeight: 375.85082

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(C(C2=CC=C(C=C2)Cl)N3C4=CC=CC=C4N=N3)O

Isomeric SMILES

C1=CC=C(C=C1)/C=C/[C@H]([C@@H](C2=CC=C(C=C2)Cl)N3C4=CC=CC=C4N=N3)O

InChI

InChI=1S/C22H18ClN3O/c23-18-13-11-17(12-14-18)22(21(27)15-10-16-6-2-1-3-7-16)26-20-9-5-4-8-19(20)24-25-26/h1-15,21-22,27H/b15-10+/t21-,22-/m1/s1