4-[[(E)-2-oxidanylidene-1-phenyl-dodec-3-enoxy]amino]butanoic acid

Systemtic Name: 4-[[(E)-2-oxidanylidene-1-phenyl-dodec-3-enoxy]amino]butanoic acid Openeye Name: 4-[[(E)-2-oxo-1-phenyl-dodec-3-enoxy]amino]butanoic acid CAS Name: 4-[[(E)-2-oxo-1-phenyldodec-3-enoxy]amino]butanoic acid IUPAC Name: 4-[[(E)-2-oxo-1-phenyldodec-3-enoxy]amino]butanoic acid Traditional Name: 4-[[(E)-2-keto-1-phenyl-dodec-3-enoxy]amino]butyric acid Formula: C22H33NO4 MolecularWeight: 375.50172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CC(=O)C(C1=CC=CC=C1)ONCCCC(=O)O

Isomeric SMILES

CCCCCCCC/C=C/C(=O)C(C1=CC=CC=C1)ONCCCC(=O)O

InChI

InChI=1S/C22H33NO4/c1-2-3-4-5-6-7-8-12-16-20(24)22(19-14-10-9-11-15-19)27-23-18-13-17-21(25)26/h9-12,14-16,22-23H,2-8,13,17-18H2,1H3,(H,25,26)/b16-12+