5-(4-chlorophenyl)-2-[dibenzofuran-2-ylsulfonyl(2-methylpropyl)amino]pentanoic acid

Systemtic Name: 5-(4-chlorophenyl)-2-[dibenzofuran-2-ylsulfonyl(2-methylpropyl)amino]pentanoic acid Openeye Name: 5-(4-chlorophenyl)-2-[dibenzofuran-2-ylsulfonyl(isobutyl)amino]pentanoic acid CAS Name: 5-(4-chlorophenyl)-2-[2-dibenzofuranylsulfonyl(2-methylpropyl)amino]pentanoic acid IUPAC Name: 5-(4-chlorophenyl)-2-[dibenzofuran-2-ylsulfonyl(2-methylpropyl)amino]pentanoic acid Traditional Name: 5-(4-chlorophenyl)-2-[dibenzofuran-2-ylsulfonyl(isobutyl)amino]valeric acid Formula: C27H28ClNO5S MolecularWeight: 514.03292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C(CCCC1=CC=C(C=C1)Cl)C(=O)O)S(=O)(=O)C2=CC3=C(C=C2)OC4=CC=CC=C43

Isomeric SMILES

CC(C)CN(C(CCCC1=CC=C(C=C1)Cl)C(=O)O)S(=O)(=O)C2=CC3=C(C=C2)OC4=CC=CC=C43

InChI

InChI=1S/C27H28ClNO5S/c1-18(2)17-29(24(27(30)31)8-5-6-19-10-12-20(28)13-11-19)35(32,33)21-14-15-26-23(16-21)22-7-3-4-9-25(22)34-26/h3-4,7,9-16,18,24H,5-6,8,17H2,1-2H3,(H,30,31)