2-[5-aminocarbonyl-9-[(4-methylsulfonylphenyl)methyl]carbazol-4-yl]oxybutanoic acid

Systemtic Name: 2-[5-aminocarbonyl-9-[(4-methylsulfonylphenyl)methyl]carbazol-4-yl]oxybutanoic acid Openeye Name: 2-[5-carbamoyl-9-[(4-methylsulfonylphenyl)methyl]carbazol-4-yl]oxybutanoic acid CAS Name: 2-[[5-carbamoyl-9-[(4-methylsulfonylphenyl)methyl]-4-carbazolyl]oxy]butanoic acid IUPAC Name: 2-[5-carbamoyl-9-[(4-methylsulfonylphenyl)methyl]carbazol-4-yl]oxybutanoic acid Traditional Name: 2-[5-carbamoyl-9-(4-mesylbenzyl)carbazol-4-yl]oxybutyric acid Formula: C25H24N2O6S MolecularWeight: 480.53286

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)OC1=CC=CC2=C1C3=C(C=CC=C3N2CC4=CC=C(C=C4)S(=O)(=O)C)C(=O)N

Isomeric SMILES

CCC(C(=O)O)OC1=CC=CC2=C1C3=C(C=CC=C3N2CC4=CC=C(C=C4)S(=O)(=O)C)C(=O)N

InChI

InChI=1S/C25H24N2O6S/c1-3-20(25(29)30)33-21-9-5-8-19-23(21)22-17(24(26)28)6-4-7-18(22)27(19)14-15-10-12-16(13-11-15)34(2,31)32/h4-13,20H,3,14H2,1-2H3,(H2,26,28)(H,29,30)