8-[(4-cyanophenyl)sulfonylamino]-4-(3-pyridin-3-ylpropyl)octanoic acid

Systemtic Name: 8-[(4-cyanophenyl)sulfonylamino]-4-(3-pyridin-3-ylpropyl)octanoic acid Openeye Name: 8-[(4-cyanophenyl)sulfonylamino]-4-[3-(3-pyridyl)propyl]octanoic acid CAS Name: 8-[(4-cyanophenyl)sulfonylamino]-4-[3-(3-pyridinyl)propyl]octanoic acid IUPAC Name: 8-[(4-cyanophenyl)sulfonylamino]-4-(3-pyridin-3-ylpropyl)octanoic acid Traditional Name: 8-[(4-cyanophenyl)sulfonylamino]-4-[3-(3-pyridyl)propyl]caprylic acid Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CCCC(CCCCNS(=O)(=O)C2=CC=C(C=C2)C#N)CCC(=O)O

Isomeric SMILES

C1=CC(=CN=C1)CCCC(CCCCNS(=O)(=O)C2=CC=C(C=C2)C#N)CCC(=O)O

InChI

InChI=1S/C23H29N3O4S/c24-17-20-9-12-22(13-10-20)31(29,30)26-16-2-1-5-19(11-14-23(27)28)6-3-7-21-8-4-15-25-18-21/h4,8-10,12-13,15,18-19,26H,1-3,5-7,11,14,16H2,(H,27,28)