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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=CC(=C2)C)S(=O)(=O)C3=CC4=C(C=C3)N(CC4)C(=O)CCC(=O)O

Isomeric SMILES

CC1CN(CCN1C2=CC=CC(=C2)C)S(=O)(=O)C3=CC4=C(C=C3)N(CC4)C(=O)CCC(=O)O

InChI

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