butyl 4-[(1-methyl-2-oxidanylidene-3H-indol-5-yl)sulfonylamino]benzoate

Systemtic Name: butyl 4-[(1-methyl-2-oxidanylidene-3H-indol-5-yl)sulfonylamino]benzoate Openeye Name: butyl 4-[(1-methyl-2-oxo-indolin-5-yl)sulfonylamino]benzoate CAS Name: 4-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]benzoic acid butyl ester IUPAC Name: butyl 4-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]benzoate Traditional Name: 4-[(2-keto-1-methyl-indolin-5-yl)sulfonylamino]benzoic acid butyl ester Formula: C20H22N2O5S MolecularWeight: 402.46408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3)C

InChI

InChI=1S/C20H22N2O5S/c1-3-4-11-27-20(24)14-5-7-16(8-6-14)21-28(25,26)17-9-10-18-15(12-17)13-19(23)22(18)2/h5-10,12,21H,3-4,11,13H2,1-2H3