ethyl 2-[[6-methoxy-5-[(4-methylphenyl)sulfonylamino]-6-oxidanylidene-hexyl]carbamoylamino]benzoate

Systemtic Name: ethyl 2-[[6-methoxy-5-[(4-methylphenyl)sulfonylamino]-6-oxidanylidene-hexyl]carbamoylamino]benzoate Openeye Name: ethyl 2-[[6-methoxy-6-oxo-5-(p-tolylsulfonylamino)hexyl]carbamoylamino]benzoate CAS Name: 2-[[[[6-methoxy-5-[(4-methylphenyl)sulfonylamino]-6-oxohexyl]amino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[6-methoxy-5-[(4-methylphenyl)sulfonylamino]-6-oxohexyl]carbamoylamino]benzoate Traditional Name: 2-[[6-keto-6-methoxy-5-(tosylamino)hexyl]carbamoylamino]benzoic acid ethyl ester Formula: C24H31N3O7S MolecularWeight: 505.58384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)NCCCCC(C(=O)OC)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)NCCCCC(C(=O)OC)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C24H31N3O7S/c1-4-34-22(28)19-9-5-6-10-20(19)26-24(30)25-16-8-7-11-21(23(29)33-3)27-35(31,32)18-14-12-17(2)13-15-18/h5-6,9-10,12-15,21,27H,4,7-8,11,16H2,1-3H3,(H2,25,26,30)