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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCCC(=O)OC2=CC3=C(C=C2)C(=C(C(=O)O3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCCC(=O)OC2=CC3=C(C=C2)C(=C(C(=O)O3)C)C

InChI

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