[3,3-diethyl-2-oxidanylidene-4-(phenylsulfonyl)azetidin-1-yl]methyl benzoate

Systemtic Name: [3,3-diethyl-2-oxidanylidene-4-(phenylsulfonyl)azetidin-1-yl]methyl benzoate Openeye Name: [2-(benzenesulfonyl)-3,3-diethyl-4-oxo-azetidin-1-yl]methyl benzoate CAS Name: benzoic acid [2-(benzenesulfonyl)-3,3-diethyl-4-oxo-1-azetidinyl]methyl ester IUPAC Name: [2-(benzenesulfonyl)-3,3-diethyl-4-oxoazetidin-1-yl]methyl benzoate Traditional Name: benzoic acid (2-besyl-3,3-diethyl-4-keto-azetidin-1-yl)methyl ester Formula: C21H23NO5S MolecularWeight: 401.47602

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(N(C1=O)COC(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)CC

Isomeric SMILES

CCC1(C(N(C1=O)COC(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)CC

InChI

InChI=1S/C21H23NO5S/c1-3-21(4-2)19(24)22(15-27-18(23)16-11-7-5-8-12-16)20(21)28(25,26)17-13-9-6-10-14-17/h5-14,20H,3-4,15H2,1-2H3