ethyl (2S,4R)-2-(benzotriazol-1-yl)-4-ethoxy-2-phenoxy-4-phenyl-butanoate

Systemtic Name: ethyl (2S,4R)-2-(benzotriazol-1-yl)-4-ethoxy-2-phenoxy-4-phenyl-butanoate Openeye Name: ethyl (2S,4R)-2-(benzotriazol-1-yl)-4-ethoxy-2-phenoxy-4-phenyl-butanoate CAS Name: (2S,4R)-2-(1-benzotriazolyl)-4-ethoxy-2-phenoxy-4-phenylbutanoic acid ethyl ester IUPAC Name: ethyl (2S,4R)-2-(benzotriazol-1-yl)-4-ethoxy-2-phenoxy-4-phenylbutanoate Traditional Name: (2S,4R)-2-(benzotriazol-1-yl)-4-ethoxy-2-phenoxy-4-phenyl-butyric acid ethyl ester Formula: C26H27N3O4 MolecularWeight: 445.51028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC(C(=O)OCC)(N1C2=CC=CC=C2N=N1)OC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCO[C@H](C[C@](C(=O)OCC)(N1C2=CC=CC=C2N=N1)OC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H27N3O4/c1-3-31-24(20-13-7-5-8-14-20)19-26(25(30)32-4-2,33-21-15-9-6-10-16-21)29-23-18-12-11-17-22(23)27-28-29/h5-18,24H,3-4,19H2,1-2H3/t24-,26+/m1/s1