7-[[3-[(4-chlorophenyl)sulfonylamino]-3-pyridin-3-yloxy-propanoyl]amino]heptanoic acid

Systemtic Name: 7-[[3-[(4-chlorophenyl)sulfonylamino]-3-pyridin-3-yloxy-propanoyl]amino]heptanoic acid Openeye Name: 7-[[3-[(4-chlorophenyl)sulfonylamino]-3-(3-pyridyloxy)propanoyl]amino]heptanoic acid CAS Name: 7-[[3-[(4-chlorophenyl)sulfonylamino]-1-oxo-3-(3-pyridinyloxy)propyl]amino]heptanoic acid IUPAC Name: 7-[[3-[(4-chlorophenyl)sulfonylamino]-3-pyridin-3-yloxypropanoyl]amino]heptanoic acid Traditional Name: 7-[[3-[(4-chlorophenyl)sulfonylamino]-3-(3-pyridyloxy)propanoyl]amino]enanthic acid Formula: C21H26ClN3O6S MolecularWeight: 483.96564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)OC(CC(=O)NCCCCCCC(=O)O)NS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC(=CN=C1)OC(CC(=O)NCCCCCCC(=O)O)NS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H26ClN3O6S/c22-16-8-10-18(11-9-16)32(29,30)25-20(31-17-6-5-12-23-15-17)14-19(26)24-13-4-2-1-3-7-21(27)28/h5-6,8-12,15,20,25H,1-4,7,13-14H2,(H,24,26)(H,27,28)