3-(3-dodec-1-ynylphenyl)-3,5-bis(oxidanyl)pentanamide

Systemtic Name: 3-(3-dodec-1-ynylphenyl)-3,5-bis(oxidanyl)pentanamide Openeye Name: 3-(3-dodec-1-ynylphenyl)-3,5-dihydroxy-pentanamide CAS Name: 3-(3-dodec-1-ynylphenyl)-3,5-dihydroxypentanamide IUPAC Name: 3-(3-dodec-1-ynylphenyl)-3,5-dihydroxypentanamide Traditional Name: 3-(3-dodec-1-ynylphenyl)-3,5-dihydroxy-valeramide Formula: C23H35NO3 MolecularWeight: 373.5289

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC#CC1=CC(=CC=C1)C(CCO)(CC(=O)N)O

Isomeric SMILES

CCCCCCCCCCC#CC1=CC(=CC=C1)C(CCO)(CC(=O)N)O

InChI

InChI=1S/C23H35NO3/c1-2-3-4-5-6-7-8-9-10-11-13-20-14-12-15-21(18-20)23(27,16-17-25)19-22(24)26/h12,14-15,18,25,27H,2-10,16-17,19H2,1H3,(H2,24,26)