O1-methyl O4-[1-[(3-morpholin-4-ylsulfonylphenyl)amino]-1-oxidanylidene-propan-2-yl] benzene-1,4-dicarboxylate

Systemtic Name: O1-methyl O4-[1-[(3-morpholin-4-ylsulfonylphenyl)amino]-1-oxidanylidene-propan-2-yl] benzene-1,4-dicarboxylate Openeye Name: O1-methyl O4-[1-methyl-2-(3-morpholinosulfonylanilino)-2-oxo-ethyl] benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O1-methyl ester O4-[1-[3-(4-morpholinylsulfonyl)anilino]-1-oxopropan-2-yl] ester IUPAC Name: 1-O-methyl 4-O-[1-(3-morpholin-4-ylsulfonylanilino)-1-oxopropan-2-yl] benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[2-keto-1-methyl-2-(3-morpholinosulfonylanilino)ethyl] ester O1-methyl ester Formula: C22H24N2O8S MolecularWeight: 476.49956

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCOCC2)OC(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCOCC2)OC(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H24N2O8S/c1-15(32-22(27)17-8-6-16(7-9-17)21(26)30-2)20(25)23-18-4-3-5-19(14-18)33(28,29)24-10-12-31-13-11-24/h3-9,14-15H,10-13H2,1-2H3,(H,23,25)