[1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] 3-[(4-acetamidophenyl)sulfonylamino]propanoate

Systemtic Name: [1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] 3-[(4-acetamidophenyl)sulfonylamino]propanoate Openeye Name: [2-(1H-indol-3-yl)-1-methyl-2-oxo-ethyl] 3-[(4-acetamidophenyl)sulfonylamino]propanoate CAS Name: 3-[(4-acetamidophenyl)sulfonylamino]propanoic acid [1-(1H-indol-3-yl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(1H-indol-3-yl)-1-oxopropan-2-yl] 3-[(4-acetamidophenyl)sulfonylamino]propanoate Traditional Name: 3-[(4-acetamidophenyl)sulfonylamino]propionic acid [2-(1H-indol-3-yl)-2-keto-1-methyl-ethyl] ester Formula: C22H23N3O6S MolecularWeight: 457.49952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)OC(=O)CCNS(=O)(=O)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC(C(=O)C1=CNC2=CC=CC=C21)OC(=O)CCNS(=O)(=O)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C22H23N3O6S/c1-14(22(28)19-13-23-20-6-4-3-5-18(19)20)31-21(27)11-12-24-32(29,30)17-9-7-16(8-10-17)25-15(2)26/h3-10,13-14,23-24H,11-12H2,1-2H3,(H,25,26)