[(2S,3S)-1-(4-methoxyphenyl)-4-oxidanylidene-3-(phenylmethoxycarbonylamino)azetidin-2-yl]methyl methanesulfonate

Systemtic Name: [(2S,3S)-1-(4-methoxyphenyl)-4-oxidanylidene-3-(phenylmethoxycarbonylamino)azetidin-2-yl]methyl methanesulfonate Openeye Name: [(2S,3S)-3-(benzyloxycarbonylamino)-1-(4-methoxyphenyl)-4-oxo-azetidin-2-yl]methyl methanesulfonate CAS Name: methanesulfonic acid [(2S,3S)-1-(4-methoxyphenyl)-4-oxo-3-(phenylmethoxycarbonylamino)-2-azetidinyl]methyl ester IUPAC Name: [(2S,3S)-1-(4-methoxyphenyl)-4-oxo-3-(phenylmethoxycarbonylamino)azetidin-2-yl]methyl methanesulfonate Traditional Name: methanesulfonic acid [(2S,3S)-3-(benzyloxycarbonylamino)-4-keto-1-(4-methoxyphenyl)azetidin-2-yl]methyl ester Formula: C20H22N2O7S MolecularWeight: 434.46288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(C(C2=O)NC(=O)OCC3=CC=CC=C3)COS(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)N2[C@@H]([C@@H](C2=O)NC(=O)OCC3=CC=CC=C3)COS(=O)(=O)C

InChI

InChI=1S/C20H22N2O7S/c1-27-16-10-8-15(9-11-16)22-17(13-29-30(2,25)26)18(19(22)23)21-20(24)28-12-14-6-4-3-5-7-14/h3-11,17-18H,12-13H2,1-2H3,(H,21,24)/t17-,18+/m1/s1