(7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(4-chlorophenyl)sulfonylamino]-3-oxidanyl-butanoate

Systemtic Name: (7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(4-chlorophenyl)sulfonylamino]-3-oxidanyl-butanoate Openeye Name: (7-bromo-2-oxo-chromen-4-yl)methyl 2-[(4-chlorophenyl)sulfonylamino]-3-hydroxy-butanoate CAS Name: 2-[(4-chlorophenyl)sulfonylamino]-3-hydroxybutanoic acid (7-bromo-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-bromo-2-oxochromen-4-yl)methyl 2-[(4-chlorophenyl)sulfonylamino]-3-hydroxybutanoate Traditional Name: 2-[(4-chlorophenyl)sulfonylamino]-3-hydroxy-butyric acid (7-bromo-2-keto-chromen-4-yl)methyl ester Formula: C20H17BrClNO7S MolecularWeight: 530.77348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)OCC1=CC(=O)OC2=C1C=CC(=C2)Br)NS(=O)(=O)C3=CC=C(C=C3)Cl)O

Isomeric SMILES

CC(C(C(=O)OCC1=CC(=O)OC2=C1C=CC(=C2)Br)NS(=O)(=O)C3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C20H17BrClNO7S/c1-11(24)19(23-31(27,28)15-5-3-14(22)4-6-15)20(26)29-10-12-8-18(25)30-17-9-13(21)2-7-16(12)17/h2-9,11,19,23-24H,10H2,1H3