[(2S,3S)-3-(3-dodec-1-ynylphenyl)oxiran-2-yl]methanol

Systemtic Name: [(2S,3S)-3-(3-dodec-1-ynylphenyl)oxiran-2-yl]methanol Openeye Name: [(2S,3S)-3-(3-dodec-1-ynylphenyl)oxiran-2-yl]methanol CAS Name: [(2S,3S)-3-(3-dodec-1-ynylphenyl)-2-oxiranyl]methanol IUPAC Name: [(2S,3S)-3-(3-dodec-1-ynylphenyl)oxiran-2-yl]methanol Traditional Name: [(2S,3S)-3-(3-dodec-1-ynylphenyl)oxiran-2-yl]methanol Formula: C21H30O2 MolecularWeight: 314.4617

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC#CC1=CC(=CC=C1)C2C(O2)CO

Isomeric SMILES

CCCCCCCCCCC#CC1=CC(=CC=C1)[C@H]2[C@@H](O2)CO

InChI

InChI=1S/C21H30O2/c1-2-3-4-5-6-7-8-9-10-11-13-18-14-12-15-19(16-18)21-20(17-22)23-21/h12,14-16,20-22H,2-10,17H2,1H3/t20-,21-/m0/s1