3-[[4-[1-(pyridin-2-ylamino)butoxy]phenyl]sulfonylamino]butanoic acid

Systemtic Name: 3-[[4-[1-(pyridin-2-ylamino)butoxy]phenyl]sulfonylamino]butanoic acid Openeye Name: 3-[[4-[1-(2-pyridylamino)butoxy]phenyl]sulfonylamino]butanoic acid CAS Name: 3-[[4-[1-(2-pyridinylamino)butoxy]phenyl]sulfonylamino]butanoic acid IUPAC Name: 3-[[4-[1-(pyridin-2-ylamino)butoxy]phenyl]sulfonylamino]butanoic acid Traditional Name: 3-[[4-[1-(2-pyridylamino)butoxy]phenyl]sulfonylamino]butyric acid Formula: C19H25N3O5S MolecularWeight: 407.4839

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(NC1=CC=CC=N1)OC2=CC=C(C=C2)S(=O)(=O)NC(C)CC(=O)O

Isomeric SMILES

CCCC(NC1=CC=CC=N1)OC2=CC=C(C=C2)S(=O)(=O)NC(C)CC(=O)O

InChI

InChI=1S/C19H25N3O5S/c1-3-6-18(21-17-7-4-5-12-20-17)27-15-8-10-16(11-9-15)28(25,26)22-14(2)13-19(23)24/h4-5,7-12,14,18,22H,3,6,13H2,1-2H3,(H,20,21)(H,23,24)