tert-butyl 2-[2-oxidanylidene-4-[(E)-3-phenylprop-2-enoxy]azetidin-1-yl]-2-phenylsulfanyl-ethanoate

Systemtic Name: tert-butyl 2-[2-oxidanylidene-4-[(E)-3-phenylprop-2-enoxy]azetidin-1-yl]-2-phenylsulfanyl-ethanoate Openeye Name: tert-butyl 2-[2-[(E)-cinnamyl]oxy-4-oxo-azetidin-1-yl]-2-phenylsulfanyl-acetate CAS Name: 2-[2-oxo-4-[(E)-3-phenylprop-2-enoxy]-1-azetidinyl]-2-(phenylthio)acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[2-oxo-4-[(E)-3-phenylprop-2-enoxy]azetidin-1-yl]-2-phenylsulfanylacetate Traditional Name: 2-[2-[(E)-cinnamyl]oxy-4-keto-azetidin-1-yl]-2-(phenylthio)acetic acid tert-butyl ester Formula: C24H27NO4S MolecularWeight: 425.54048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(N1C(CC1=O)OCC=CC2=CC=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)C(N1C(CC1=O)OC/C=C/C2=CC=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C24H27NO4S/c1-24(2,3)29-23(27)22(30-19-14-8-5-9-15-19)25-20(26)17-21(25)28-16-10-13-18-11-6-4-7-12-18/h4-15,21-22H,16-17H2,1-3H3/b13-10+