8-[(4-chlorophenyl)sulfonylamino]-4-(2-imidazol-1-ylethyl)octanoic acid

Systemtic Name: 8-[(4-chlorophenyl)sulfonylamino]-4-(2-imidazol-1-ylethyl)octanoic acid Openeye Name: 8-[(4-chlorophenyl)sulfonylamino]-4-(2-imidazol-1-ylethyl)octanoic acid CAS Name: 8-[(4-chlorophenyl)sulfonylamino]-4-[2-(1-imidazolyl)ethyl]octanoic acid IUPAC Name: 8-[(4-chlorophenyl)sulfonylamino]-4-(2-imidazol-1-ylethyl)octanoic acid Traditional Name: 8-[(4-chlorophenyl)sulfonylamino]-4-(2-imidazol-1-ylethyl)caprylic acid Formula: C19H26ClN3O4S MolecularWeight: 427.94544

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1S(=O)(=O)NCCCCC(CCC(=O)O)CCN2C=CN=C2)Cl

Isomeric SMILES

C1=CC(=CC=C1S(=O)(=O)NCCCCC(CCC(=O)O)CCN2C=CN=C2)Cl

InChI

InChI=1S/C19H26ClN3O4S/c20-17-5-7-18(8-6-17)28(26,27)22-11-2-1-3-16(4-9-19(24)25)10-13-23-14-12-21-15-23/h5-8,12,14-16,22H,1-4,9-11,13H2,(H,24,25)