(3,4-dimethyl-2-oxidanylidene-chromen-7-yl) 2-[(4-methylphenyl)sulfonylamino]butanoate

Systemtic Name: (3,4-dimethyl-2-oxidanylidene-chromen-7-yl) 2-[(4-methylphenyl)sulfonylamino]butanoate Openeye Name: (3,4-dimethyl-2-oxo-chromen-7-yl) 2-(p-tolylsulfonylamino)butanoate CAS Name: 2-[(4-methylphenyl)sulfonylamino]butanoic acid (3,4-dimethyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (3,4-dimethyl-2-oxochromen-7-yl) 2-[(4-methylphenyl)sulfonylamino]butanoate Traditional Name: 2-(tosylamino)butyric acid (2-keto-3,4-dimethyl-chromen-7-yl) ester Formula: C22H23NO6S MolecularWeight: 429.48612

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC1=CC2=C(C=C1)C(=C(C(=O)O2)C)C)NS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC(C(=O)OC1=CC2=C(C=C1)C(=C(C(=O)O2)C)C)NS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H23NO6S/c1-5-19(23-30(26,27)17-9-6-13(2)7-10-17)22(25)28-16-8-11-18-14(3)15(4)21(24)29-20(18)12-16/h6-12,19,23H,5H2,1-4H3