[2-(4-morpholin-4-ylsulfonylphenyl)-2-oxidanylidene-ethyl] 4-methylbenzoate

Systemtic Name: [2-(4-morpholin-4-ylsulfonylphenyl)-2-oxidanylidene-ethyl] 4-methylbenzoate Openeye Name: [2-(4-morpholinosulfonylphenyl)-2-oxo-ethyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [2-[4-(4-morpholinylsulfonyl)phenyl]-2-oxoethyl] ester IUPAC Name: [2-(4-morpholin-4-ylsulfonylphenyl)-2-oxoethyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [2-keto-2-(4-morpholinosulfonylphenyl)ethyl] ester Formula: C20H21NO6S MolecularWeight: 403.44884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OCC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OCC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H21NO6S/c1-15-2-4-17(5-3-15)20(23)27-14-19(22)16-6-8-18(9-7-16)28(24,25)21-10-12-26-13-11-21/h2-9H,10-14H2,1H3