[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl] 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate

Systemtic Name: [2-(3-methoxyphenyl)-2-oxidanylidene-ethyl] 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate Openeye Name: [2-(3-methoxyphenyl)-2-oxo-ethyl] 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate CAS Name: 4-[(2,6-dimethyl-4-morpholinyl)sulfonyl]benzoic acid [2-(3-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-methoxyphenyl)-2-oxoethyl] 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate Traditional Name: 4-(2,6-dimethylmorpholino)sulfonylbenzoic acid [2-keto-2-(3-methoxyphenyl)ethyl] ester Formula: C22H25NO7S MolecularWeight: 447.5014

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC(=O)C3=CC(=CC=C3)OC

Isomeric SMILES

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC(=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C22H25NO7S/c1-15-12-23(13-16(2)30-15)31(26,27)20-9-7-17(8-10-20)22(25)29-14-21(24)18-5-4-6-19(11-18)28-3/h4-11,15-16H,12-14H2,1-3H3