4-oxidanylidene-4-[[(Z)-1-(2-sulfanylphenyl)dodec-1-enyl]amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[[(Z)-1-(2-sulfanylphenyl)dodec-1-enyl]amino]butanoic acid Openeye Name: 4-oxo-4-[[(Z)-1-(2-sulfanylphenyl)dodec-1-enyl]amino]butanoic acid CAS Name: 4-[[(Z)-1-(2-mercaptophenyl)dodec-1-enyl]amino]-4-oxobutanoic acid IUPAC Name: 4-oxo-4-[[(Z)-1-(2-sulfanylphenyl)dodec-1-enyl]amino]butanoic acid Traditional Name: 4-keto-4-[[(Z)-1-(2-mercaptophenyl)dodec-1-enyl]amino]butyric acid Formula: C22H33NO3S MolecularWeight: 391.56732

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC=C(C1=CC=CC=C1S)NC(=O)CCC(=O)O

Isomeric SMILES

CCCCCCCCCC/C=C(/C1=CC=CC=C1S)\NC(=O)CCC(=O)O

InChI

InChI=1S/C22H33NO3S/c1-2-3-4-5-6-7-8-9-10-14-19(18-13-11-12-15-20(18)27)23-21(24)16-17-22(25)26/h11-15,27H,2-10,16-17H2,1H3,(H,23,24)(H,25,26)/b19-14-