methyl 3-[[2-(3-methanoylphenyl)-2-oxidanyl-ethanoyl]amino]-4-methyl-2-(4-oxidanylideneazetidin-2-yl)benzenesulfonate

Systemtic Name: methyl 3-[[2-(3-methanoylphenyl)-2-oxidanyl-ethanoyl]amino]-4-methyl-2-(4-oxidanylideneazetidin-2-yl)benzenesulfonate Openeye Name: methyl 3-[[2-(3-formylphenyl)-2-hydroxy-acetyl]amino]-4-methyl-2-(4-oxoazetidin-2-yl)benzenesulfonate CAS Name: 3-[[2-(3-formylphenyl)-2-hydroxy-1-oxoethyl]amino]-4-methyl-2-(4-oxo-2-azetidinyl)benzenesulfonic acid methyl ester IUPAC Name: methyl 3-[[2-(3-formylphenyl)-2-hydroxyacetyl]amino]-4-methyl-2-(4-oxoazetidin-2-yl)benzenesulfonate Traditional Name: 3-[[2-(3-formylphenyl)-2-hydroxy-acetyl]amino]-2-(4-ketoazetidin-2-yl)-4-methyl-benzenesulfonic acid methyl ester Formula: C20H20N2O7S MolecularWeight: 432.447

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)S(=O)(=O)OC)C2CC(=O)N2)NC(=O)C(C3=CC=CC(=C3)C=O)O

Isomeric SMILES

CC1=C(C(=C(C=C1)S(=O)(=O)OC)C2CC(=O)N2)NC(=O)C(C3=CC=CC(=C3)C=O)O

InChI

InChI=1S/C20H20N2O7S/c1-11-6-7-15(30(27,28)29-2)17(14-9-16(24)21-14)18(11)22-20(26)19(25)13-5-3-4-12(8-13)10-23/h3-8,10,14,19,25H,9H2,1-2H3,(H,21,24)(H,22,26)