(8-methoxy-4-methyl-6-oxidanylidene-benzo[c]chromen-3-yl) 4-[(4-methylphenyl)sulfonylamino]butanoate

Systemtic Name: (8-methoxy-4-methyl-6-oxidanylidene-benzo[c]chromen-3-yl) 4-[(4-methylphenyl)sulfonylamino]butanoate Openeye Name: (8-methoxy-4-methyl-6-oxo-benzo[c]chromen-3-yl) 4-(p-tolylsulfonylamino)butanoate CAS Name: 4-[(4-methylphenyl)sulfonylamino]butanoic acid (8-methoxy-4-methyl-6-oxo-3-benzo[c][1]benzopyranyl) ester IUPAC Name: (8-methoxy-4-methyl-6-oxobenzo[c]chromen-3-yl) 4-[(4-methylphenyl)sulfonylamino]butanoate Traditional Name: 4-(tosylamino)butyric acid (6-keto-8-methoxy-4-methyl-benzo[c]chromen-3-yl) ester Formula: C26H25NO7S MolecularWeight: 495.5442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCCC(=O)OC2=C(C3=C(C=C2)C4=C(C=C(C=C4)OC)C(=O)O3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCCC(=O)OC2=C(C3=C(C=C2)C4=C(C=C(C=C4)OC)C(=O)O3)C

InChI

InChI=1S/C26H25NO7S/c1-16-6-9-19(10-7-16)35(30,31)27-14-4-5-24(28)33-23-13-12-21-20-11-8-18(32-3)15-22(20)26(29)34-25(21)17(23)2/h6-13,15,27H,4-5,14H2,1-3H3