(4-methoxyphenyl)methyl 2-(3-chloranyl-2-ethanoylsulfanyl-4-oxidanylidene-azetidin-1-yl)-3-methyl-but-2-enoate

Systemtic Name: (4-methoxyphenyl)methyl 2-(3-chloranyl-2-ethanoylsulfanyl-4-oxidanylidene-azetidin-1-yl)-3-methyl-but-2-enoate Openeye Name: (4-methoxyphenyl)methyl 2-(2-acetylsulfanyl-3-chloro-4-oxo-azetidin-1-yl)-3-methyl-but-2-enoate CAS Name: 2-[2-(acetylthio)-3-chloro-4-oxo-1-azetidinyl]-3-methyl-2-butenoic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl 2-(2-acetylsulfanyl-3-chloro-4-oxoazetidin-1-yl)-3-methylbut-2-enoate Traditional Name: 2-[2-(acetylthio)-3-chloro-4-keto-azetidin-1-yl]-3-methyl-but-2-enoic acid p-anisyl ester Formula: C18H20ClNO5S MolecularWeight: 397.8731

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)OCC1=CC=C(C=C1)OC)N2C(C(C2=O)Cl)SC(=O)C)C

Isomeric SMILES

CC(=C(C(=O)OCC1=CC=C(C=C1)OC)N2C(C(C2=O)Cl)SC(=O)C)C

InChI

InChI=1S/C18H20ClNO5S/c1-10(2)15(20-16(22)14(19)17(20)26-11(3)21)18(23)25-9-12-5-7-13(24-4)8-6-12/h5-8,14,17H,9H2,1-4H3