6-(2,3-dihydroindol-1-yl)-6-oxidanylidene-3-[[4-(4-pyrrolidin-1-ylphenyl)phenyl]sulfonylamino]hexanoic acid

Systemtic Name: 6-(2,3-dihydroindol-1-yl)-6-oxidanylidene-3-[[4-(4-pyrrolidin-1-ylphenyl)phenyl]sulfonylamino]hexanoic acid Openeye Name: 6-indolin-1-yl-6-oxo-3-[[4-(4-pyrrolidin-1-ylphenyl)phenyl]sulfonylamino]hexanoic acid CAS Name: 6-(2,3-dihydroindol-1-yl)-6-oxo-3-[[4-[4-(1-pyrrolidinyl)phenyl]phenyl]sulfonylamino]hexanoic acid IUPAC Name: 6-(2,3-dihydroindol-1-yl)-6-oxo-3-[[4-(4-pyrrolidin-1-ylphenyl)phenyl]sulfonylamino]hexanoic acid Traditional Name: 6-indolin-1-yl-6-keto-3-[[4-(4-pyrrolidinophenyl)phenyl]sulfonylamino]hexanoic acid Formula: C30H33N3O5S MolecularWeight: 547.66512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)C3=CC=C(C=C3)S(=O)(=O)NC(CCC(=O)N4CCC5=CC=CC=C54)CC(=O)O

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)C3=CC=C(C=C3)S(=O)(=O)NC(CCC(=O)N4CCC5=CC=CC=C54)CC(=O)O

InChI

InChI=1S/C30H33N3O5S/c34-29(33-20-17-24-5-1-2-6-28(24)33)16-11-25(21-30(35)36)31-39(37,38)27-14-9-23(10-15-27)22-7-12-26(13-8-22)32-18-3-4-19-32/h1-2,5-10,12-15,25,31H,3-4,11,16-21H2,(H,35,36)