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

Systemtic Name: (E,1S,2R)-2-(benzotriazol-1-yl)-4-(4-methoxyphenyl)-1-phenyl-but-3-en-1-ol Openeye Name: (E,1S,2R)-2-(benzotriazol-1-yl)-4-(4-methoxyphenyl)-1-phenyl-but-3-en-1-ol CAS Name: (E,1S,2R)-2-(1-benzotriazolyl)-4-(4-methoxyphenyl)-1-phenyl-3-buten-1-ol IUPAC Name: (E,1S,2R)-2-(benzotriazol-1-yl)-4-(4-methoxyphenyl)-1-phenylbut-3-en-1-ol Traditional Name: (E,1S,2R)-2-(benzotriazol-1-yl)-4-(4-methoxyphenyl)-1-phenyl-but-3-en-1-ol Formula: C23H21N3O2 MolecularWeight: 371.43174

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC(C(C2=CC=CC=C2)O)N3C4=CC=CC=C4N=N3

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/[C@H]([C@H](C2=CC=CC=C2)O)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C23H21N3O2/c1-28-19-14-11-17(12-15-19)13-16-22(23(27)18-7-3-2-4-8-18)26-21-10-6-5-9-20(21)24-25-26/h2-16,22-23,27H,1H3/b16-13+/t22-,23+/m1/s1