acetyloxymethyl 2-[3-(aminocarbonylamino)-2-chloranylsulfinyl-4-oxidanylidene-azetidin-1-yl]-3-methyl-but-3-enoate; (4-methoxyphenyl)methanol

Systemtic Name: acetyloxymethyl 2-[3-(aminocarbonylamino)-2-chloranylsulfinyl-4-oxidanylidene-azetidin-1-yl]-3-methyl-but-3-enoate; (4-methoxyphenyl)methanol Openeye Name: acetoxymethyl 2-(2-chlorosulfinyl-4-oxo-3-ureido-azetidin-1-yl)-3-methyl-but-3-enoate; (4-methoxyphenyl)methanol CAS Name: 2-[3-(carbamoylamino)-2-chlorosulfinyl-4-oxo-1-azetidinyl]-3-methyl-3-butenoic acid acetyloxymethyl ester; (4-methoxyphenyl)methanol IUPAC Name: acetyloxymethyl 2-[3-(carbamoylamino)-2-chlorosulfinyl-4-oxoazetidin-1-yl]-3-methylbut-3-enoate; (4-methoxyphenyl)methanol Traditional Name: 2-(2-chlorosulfinyl-4-keto-3-ureido-azetidin-1-yl)-3-methyl-but-3-enoic acid acetoxymethyl ester; (4-methoxyphenyl)methanol Formula: C20H26ClN3O9S MolecularWeight: 519.95314

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(C(=O)OCOC(=O)C)N1C(C(C1=O)NC(=O)N)S(=O)Cl.COC1=CC=C(C=C1)CO

Isomeric SMILES

CC(=C)C(C(=O)OCOC(=O)C)N1C(C(C1=O)NC(=O)N)S(=O)Cl.COC1=CC=C(C=C1)CO

InChI

InChI=1S/C12H16ClN3O7S.C8H10O2/c1-5(2)8(11(19)23-4-22-6(3)17)16-9(18)7(15-12(14)20)10(16)24(13)21;1-10-8-4-2-7(6-9)3-5-8/h7-8,10H,1,4H2,2-3H3,(H3,14,15,20);2-5,9H,6H2,1H3