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

Systemtic Name: 2-[5-aminocarbonyl-9-[(2-methylsulfonylphenyl)methyl]carbazol-4-yl]oxypentanoic acid Openeye Name: 2-[5-carbamoyl-9-[(2-methylsulfonylphenyl)methyl]carbazol-4-yl]oxypentanoic acid CAS Name: 2-[[5-carbamoyl-9-[(2-methylsulfonylphenyl)methyl]-4-carbazolyl]oxy]pentanoic acid IUPAC Name: 2-[5-carbamoyl-9-[(2-methylsulfonylphenyl)methyl]carbazol-4-yl]oxypentanoic acid Traditional Name: 2-[5-carbamoyl-9-(2-mesylbenzyl)carbazol-4-yl]oxyvaleric acid Formula: C26H26N2O6S MolecularWeight: 494.55944

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)OC1=CC=CC2=C1C3=C(C=CC=C3N2CC4=CC=CC=C4S(=O)(=O)C)C(=O)N

Isomeric SMILES

CCCC(C(=O)O)OC1=CC=CC2=C1C3=C(C=CC=C3N2CC4=CC=CC=C4S(=O)(=O)C)C(=O)N

InChI

InChI=1S/C26H26N2O6S/c1-3-8-21(26(30)31)34-20-13-7-12-19-24(20)23-17(25(27)29)10-6-11-18(23)28(19)15-16-9-4-5-14-22(16)35(2,32)33/h4-7,9-14,21H,3,8,15H2,1-2H3,(H2,27,29)(H,30,31)