propan-2-yl (2S)-2-ethoxy-3-[4-[(E)-5-phenylpent-2-en-4-ynoxy]-3,5-ditritio-phenyl]propanoate

Systemtic Name: propan-2-yl (2S)-2-ethoxy-3-[4-[(E)-5-phenylpent-2-en-4-ynoxy]-3,5-ditritio-phenyl]propanoate Openeye Name: isopropyl (2S)-2-ethoxy-3-[4-[(E)-5-phenylpent-2-en-4-ynoxy]-3,5-ditritio-phenyl]propanoate CAS Name: (2S)-2-ethoxy-3-[4-[(E)-5-phenylpent-2-en-4-ynoxy]-3,5-ditritiophenyl]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (2S)-2-ethoxy-3-[4-[(E)-5-phenylpent-2-en-4-ynoxy]-3,5-ditritiophenyl]propanoate Traditional Name: (2S)-2-ethoxy-3-[4-[(E)-5-phenylpent-2-en-4-ynoxy]-3,5-ditritio-phenyl]propionic acid isopropyl ester Formula: C25H28O4 MolecularWeight: 396.503639

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)OCC=CC#CC2=CC=CC=C2)C(=O)OC(C)C

Isomeric SMILES

[3H]C1=CC(=CC(=C1OC/C=C/C#CC2=CC=CC=C2)[3H])C[C@@H](C(=O)OC(C)C)OCC

InChI

InChI=1S/C25H28O4/c1-4-27-24(25(26)29-20(2)3)19-22-14-16-23(17-15-22)28-18-10-6-9-13-21-11-7-5-8-12-21/h5-8,10-12,14-17,20,24H,4,18-19H2,1-3H3/b10-6+/t24-/m0/s1/i16T,17T