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

Systemtic Name: (7-methyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(4-chlorophenyl)sulfonylamino]-3-oxidanyl-butanoate Openeye Name: (7-methyl-2-oxo-chromen-4-yl)methyl 2-[(4-chlorophenyl)sulfonylamino]-3-hydroxy-butanoate CAS Name: 2-[(4-chlorophenyl)sulfonylamino]-3-hydroxybutanoic acid (7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxochromen-4-yl)methyl 2-[(4-chlorophenyl)sulfonylamino]-3-hydroxybutanoate Traditional Name: 2-[(4-chlorophenyl)sulfonylamino]-3-hydroxy-butyric acid (2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C21H20ClNO7S MolecularWeight: 465.904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C(C(C)O)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C(C(C)O)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H20ClNO7S/c1-12-3-8-17-14(10-19(25)30-18(17)9-12)11-29-21(26)20(13(2)24)23-31(27,28)16-6-4-15(22)5-7-16/h3-10,13,20,23-24H,11H2,1-2H3