(2S)-2-(benzotriazol-1-yl)-2-ethoxy-1,1,4-triphenyl-but-3-yn-1-ol

Systemtic Name: (2S)-2-(benzotriazol-1-yl)-2-ethoxy-1,1,4-triphenyl-but-3-yn-1-ol Openeye Name: (2S)-2-(benzotriazol-1-yl)-2-ethoxy-1,1,4-triphenyl-but-3-yn-1-ol CAS Name: (2S)-2-(1-benzotriazolyl)-2-ethoxy-1,1,4-triphenyl-3-butyn-1-ol IUPAC Name: (2S)-2-(benzotriazol-1-yl)-2-ethoxy-1,1,4-triphenylbut-3-yn-1-ol Traditional Name: (2S)-2-(benzotriazol-1-yl)-2-ethoxy-1,1,4-triphenyl-but-3-yn-1-ol Formula: C30H25N3O2 MolecularWeight: 459.5384

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H25N3O2/c1-2-35-29(23-22-24-14-6-3-7-15-24,33-28-21-13-12-20-27(28)31-32-33)30(34,25-16-8-4-9-17-25)26-18-10-5-11-19-26/h3-21,34H,2H2,1H3/t29-/m0/s1