[1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate

Systemtic Name: [1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate Openeye Name: [2-(4-ethylphenyl)-1-methyl-2-oxo-ethyl] 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate CAS Name: 4-[(2,6-dimethyl-4-morpholinyl)sulfonyl]benzoic acid [1-(4-ethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-ethylphenyl)-1-oxopropan-2-yl] 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate Traditional Name: 4-(2,6-dimethylmorpholino)sulfonylbenzoic acid [2-(4-ethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C24H29NO6S MolecularWeight: 459.55516

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CC(OC(C3)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CC(OC(C3)C)C

InChI

InChI=1S/C24H29NO6S/c1-5-19-6-8-20(9-7-19)23(26)18(4)31-24(27)21-10-12-22(13-11-21)32(28,29)25-14-16(2)30-17(3)15-25/h6-13,16-18H,5,14-15H2,1-4H3