[2-oxidanylidene-2-(3,4,5-trimethoxyphenyl)ethyl] 2-(5-morpholin-4-ylsulfonylthiophen-2-yl)ethanoate

Systemtic Name: [2-oxidanylidene-2-(3,4,5-trimethoxyphenyl)ethyl] 2-(5-morpholin-4-ylsulfonylthiophen-2-yl)ethanoate Openeye Name: [2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl] 2-(5-morpholinosulfonyl-2-thienyl)acetate CAS Name: 2-[5-(4-morpholinylsulfonyl)-2-thiophenyl]acetic acid [2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl] 2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetate Traditional Name: 2-(5-morpholinosulfonyl-2-thienyl)acetic acid [2-keto-2-(3,4,5-trimethoxyphenyl)ethyl] ester Formula: C21H25NO9S2 MolecularWeight: 499.5545

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)COC(=O)CC2=CC=C(S2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)COC(=O)CC2=CC=C(S2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H25NO9S2/c1-27-17-10-14(11-18(28-2)21(17)29-3)16(23)13-31-19(24)12-15-4-5-20(32-15)33(25,26)22-6-8-30-9-7-22/h4-5,10-11H,6-9,12-13H2,1-3H3