(7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 3-(4-morpholin-4-ylsulfonylphenyl)propanoate

Systemtic Name: (7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 3-(4-morpholin-4-ylsulfonylphenyl)propanoate Openeye Name: (7-acetamido-2-oxo-chromen-4-yl)methyl 3-(4-morpholinosulfonylphenyl)propanoate CAS Name: 3-[4-(4-morpholinylsulfonyl)phenyl]propanoic acid (7-acetamido-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-acetamido-2-oxochromen-4-yl)methyl 3-(4-morpholin-4-ylsulfonylphenyl)propanoate Traditional Name: 3-(4-morpholinosulfonylphenyl)propionic acid (7-acetamido-2-keto-chromen-4-yl)methyl ester Formula: C25H26N2O8S MolecularWeight: 514.54754

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C25H26N2O8S/c1-17(28)26-20-5-8-22-19(14-25(30)35-23(22)15-20)16-34-24(29)9-4-18-2-6-21(7-3-18)36(31,32)27-10-12-33-13-11-27/h2-3,5-8,14-15H,4,9-13,16H2,1H3,(H,26,28)