[2-oxidanyl-3-propanoyl-6-(quinolin-8-ylsulfonylamino)indol-1-yl] 2,2-dimethylpropanoate

Systemtic Name: [2-oxidanyl-3-propanoyl-6-(quinolin-8-ylsulfonylamino)indol-1-yl] 2,2-dimethylpropanoate Openeye Name: [2-hydroxy-3-propanoyl-6-(8-quinolylsulfonylamino)indol-1-yl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [2-hydroxy-3-(1-oxopropyl)-6-(8-quinolinylsulfonylamino)-1-indolyl] ester IUPAC Name: [2-hydroxy-3-propanoyl-6-(quinolin-8-ylsulfonylamino)indol-1-yl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [2-hydroxy-3-propionyl-6-(8-quinolylsulfonylamino)indol-1-yl] ester Formula: C25H25N3O6S MolecularWeight: 495.5475

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(N(C2=C1C=CC(=C2)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4)OC(=O)C(C)(C)C)O

Isomeric SMILES

CCC(=O)C1=C(N(C2=C1C=CC(=C2)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4)OC(=O)C(C)(C)C)O

InChI

InChI=1S/C25H25N3O6S/c1-5-19(29)21-17-12-11-16(14-18(17)28(23(21)30)34-24(31)25(2,3)4)27-35(32,33)20-10-6-8-15-9-7-13-26-22(15)20/h6-14,27,30H,5H2,1-4H3