3-[(4-chlorophenyl)sulfonylamino]-2-phenyl-2-propyl-octanoic acid

Systemtic Name: 3-[(4-chlorophenyl)sulfonylamino]-2-phenyl-2-propyl-octanoic acid Openeye Name: 3-[(4-chlorophenyl)sulfonylamino]-2-phenyl-2-propyl-octanoic acid CAS Name: 3-[(4-chlorophenyl)sulfonylamino]-2-phenyl-2-propyloctanoic acid IUPAC Name: 3-[(4-chlorophenyl)sulfonylamino]-2-phenyl-2-propyloctanoic acid Traditional Name: 3-[(4-chlorophenyl)sulfonylamino]-2-phenyl-2-propyl-caprylic acid Formula: C23H30ClNO4S MolecularWeight: 452.0066

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(CCC)(C1=CC=CC=C1)C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCCC(C(CCC)(C1=CC=CC=C1)C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C23H30ClNO4S/c1-3-5-7-12-21(25-30(28,29)20-15-13-19(24)14-16-20)23(17-4-2,22(26)27)18-10-8-6-9-11-18/h6,8-11,13-16,21,25H,3-5,7,12,17H2,1-2H3,(H,26,27)