(4-methoxyphenyl)methyl 2-[3-(2-chloranylethanoylamino)-2-chloranylsulfinyl-4-oxidanylidene-azetidin-1-yl]-3-methyl-but-3-enoate

Systemtic Name: (4-methoxyphenyl)methyl 2-[3-(2-chloranylethanoylamino)-2-chloranylsulfinyl-4-oxidanylidene-azetidin-1-yl]-3-methyl-but-3-enoate Openeye Name: (4-methoxyphenyl)methyl 2-[3-[(2-chloroacetyl)amino]-2-chlorosulfinyl-4-oxo-azetidin-1-yl]-3-methyl-but-3-enoate CAS Name: 2-[3-[(2-chloro-1-oxoethyl)amino]-2-chlorosulfinyl-4-oxo-1-azetidinyl]-3-methyl-3-butenoic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl 2-[3-[(2-chloroacetyl)amino]-2-chlorosulfinyl-4-oxoazetidin-1-yl]-3-methylbut-3-enoate Traditional Name: 2-[3-[(2-chloroacetyl)amino]-2-chlorosulfinyl-4-keto-azetidin-1-yl]-3-methyl-but-3-enoic acid p-anisyl ester Formula: C18H20Cl2N2O6S MolecularWeight: 463.3322

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(C(=O)OCC1=CC=C(C=C1)OC)N2C(C(C2=O)NC(=O)CCl)S(=O)Cl

Isomeric SMILES

CC(=C)C(C(=O)OCC1=CC=C(C=C1)OC)N2C(C(C2=O)NC(=O)CCl)S(=O)Cl

InChI

InChI=1S/C18H20Cl2N2O6S/c1-10(2)15(18(25)28-9-11-4-6-12(27-3)7-5-11)22-16(24)14(17(22)29(20)26)21-13(23)8-19/h4-7,14-15,17H,1,8-9H2,2-3H3,(H,21,23)