[2-methyl-3-[(4-methylphenyl)carbonylamino]-4-oxidanylidene-azetidin-1-yl]methanesulfonic acid

Systemtic Name: [2-methyl-3-[(4-methylphenyl)carbonylamino]-4-oxidanylidene-azetidin-1-yl]methanesulfonic acid Openeye Name: [2-methyl-3-[(4-methylbenzoyl)amino]-4-oxo-azetidin-1-yl]methanesulfonic acid CAS Name: [2-methyl-3-[[(4-methylphenyl)-oxomethyl]amino]-4-oxo-1-azetidinyl]methanesulfonic acid IUPAC Name: [2-methyl-3-[(4-methylbenzoyl)amino]-4-oxoazetidin-1-yl]methanesulfonic acid Traditional Name: [2-keto-4-methyl-3-(p-toluoylamino)azetidin-1-yl]methanesulfonic acid Formula: C13H16N2O5S MolecularWeight: 312.34154

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=O)N1CS(=O)(=O)O)NC(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC1C(C(=O)N1CS(=O)(=O)O)NC(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C13H16N2O5S/c1-8-3-5-10(6-4-8)12(16)14-11-9(2)15(13(11)17)7-21(18,19)20/h3-6,9,11H,7H2,1-2H3,(H,14,16)(H,18,19,20)