4-[5-[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonyl-2,3-dihydroindol-1-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[5-[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonyl-2,3-dihydroindol-1-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[5-[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonylindolin-1-yl]-4-oxo-butanoic acid CAS Name: 4-[5-[[4-(2,5-dimethylphenyl)-1-piperazinyl]sulfonyl]-2,3-dihydroindol-1-yl]-4-oxobutanoic acid IUPAC Name: 4-[5-[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonyl-2,3-dihydroindol-1-yl]-4-oxobutanoic acid Traditional Name: 4-[5-[4-(2,5-dimethylphenyl)piperazino]sulfonylindolin-1-yl]-4-keto-butyric acid Formula: C24H29N3O5S MolecularWeight: 471.56916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)N(CC4)C(=O)CCC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)N(CC4)C(=O)CCC(=O)O

InChI

InChI=1S/C24H29N3O5S/c1-17-3-4-18(2)22(15-17)25-11-13-26(14-12-25)33(31,32)20-5-6-21-19(16-20)9-10-27(21)23(28)7-8-24(29)30/h3-6,15-16H,7-14H2,1-2H3,(H,29,30)