(4-methoxyphenyl)methyl 2-[(2R,3S)-3-ethyl-1-(4-methylphenyl)sulfonyl-4-oxidanylidene-azetidin-2-yl]ethanoate

Systemtic Name: (4-methoxyphenyl)methyl 2-[(2R,3S)-3-ethyl-1-(4-methylphenyl)sulfonyl-4-oxidanylidene-azetidin-2-yl]ethanoate Openeye Name: (4-methoxyphenyl)methyl 2-[(2R,3S)-3-ethyl-4-oxo-1-(p-tolylsulfonyl)azetidin-2-yl]acetate CAS Name: 2-[(2R,3S)-3-ethyl-1-(4-methylphenyl)sulfonyl-4-oxo-2-azetidinyl]acetic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl 2-[(2R,3S)-3-ethyl-1-(4-methylphenyl)sulfonyl-4-oxoazetidin-2-yl]acetate Traditional Name: 2-[(2R,3S)-3-ethyl-4-keto-1-tosyl-azetidin-2-yl]acetic acid p-anisyl ester Formula: C22H25NO6S MolecularWeight: 431.502

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(N(C1=O)S(=O)(=O)C2=CC=C(C=C2)C)CC(=O)OCC3=CC=C(C=C3)OC

Isomeric SMILES

CC[C@H]1[C@H](N(C1=O)S(=O)(=O)C2=CC=C(C=C2)C)CC(=O)OCC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H25NO6S/c1-4-19-20(13-21(24)29-14-16-7-9-17(28-3)10-8-16)23(22(19)25)30(26,27)18-11-5-15(2)6-12-18/h5-12,19-20H,4,13-14H2,1-3H3/t19-,20+/m0/s1