3-[[4-[2-(4-cyanophenoxy)propanoylamino]phenyl]sulfonylamino]propanoic acid

Systemtic Name: 3-[[4-[2-(4-cyanophenoxy)propanoylamino]phenyl]sulfonylamino]propanoic acid Openeye Name: 3-[[4-[2-(4-cyanophenoxy)propanoylamino]phenyl]sulfonylamino]propanoic acid CAS Name: 3-[[4-[[2-(4-cyanophenoxy)-1-oxopropyl]amino]phenyl]sulfonylamino]propanoic acid IUPAC Name: 3-[[4-[2-(4-cyanophenoxy)propanoylamino]phenyl]sulfonylamino]propanoic acid Traditional Name: 3-[[4-[2-(4-cyanophenoxy)propanoylamino]phenyl]sulfonylamino]propionic acid Formula: C19H19N3O6S MolecularWeight: 417.43566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)O)OC2=CC=C(C=C2)C#N

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)O)OC2=CC=C(C=C2)C#N

InChI

InChI=1S/C19H19N3O6S/c1-13(28-16-6-2-14(12-20)3-7-16)19(25)22-15-4-8-17(9-5-15)29(26,27)21-11-10-18(23)24/h2-9,13,21H,10-11H2,1H3,(H,22,25)(H,23,24)