2-[[1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]-2-methyl-1-oxidanylidene-propan-2-yl]sulfonylmethyl]-3-phenyl-propanoate

Systemtic Name: 2-[[1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]-2-methyl-1-oxidanylidene-propan-2-yl]sulfonylmethyl]-3-phenyl-propanoate Openeye Name: 2-benzyl-3-[2-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]-1,1-dimethyl-2-oxo-ethyl]sulfonyl-propanoate CAS Name: 2-[[1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]-2-methyl-1-oxopropan-2-yl]sulfonylmethyl]-3-phenylpropanoate IUPAC Name: 2-benzyl-3-[1-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]-2-methyl-1-oxopropan-2-yl]sulfonylpropanoate Traditional Name: 2-benzyl-3-[2-[(2,2-dimethyl-1,3-dioxolan-4-yl)methoxy]-2-keto-1,1-dimethyl-ethyl]sulfonyl-propionate Formula: C20H27O8S- MolecularWeight: 427.48858

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)COC(=O)C(C)(C)S(=O)(=O)CC(CC2=CC=CC=C2)C(=O)[O-])C

Isomeric SMILES

CC1(OCC(O1)COC(=O)C(C)(C)S(=O)(=O)CC(CC2=CC=CC=C2)C(=O)[O-])C

InChI

InChI=1S/C20H28O8S/c1-19(2,18(23)26-11-16-12-27-20(3,4)28-16)29(24,25)13-15(17(21)22)10-14-8-6-5-7-9-14/h5-9,15-16H,10-13H2,1-4H3,(H,21,22)/p-1