3-phenyl-3-[[3-[5-(pyridin-2-ylamino)pentoxy]phenyl]sulfonylamino]propanoic acid

Systemtic Name: 3-phenyl-3-[[3-[5-(pyridin-2-ylamino)pentoxy]phenyl]sulfonylamino]propanoic acid Openeye Name: 3-phenyl-3-[[3-[5-(2-pyridylamino)pentoxy]phenyl]sulfonylamino]propanoic acid CAS Name: 3-phenyl-3-[[3-[5-(2-pyridinylamino)pentoxy]phenyl]sulfonylamino]propanoic acid IUPAC Name: 3-phenyl-3-[[3-[5-(pyridin-2-ylamino)pentoxy]phenyl]sulfonylamino]propanoic acid Traditional Name: 3-phenyl-3-[[3-[5-(2-pyridylamino)pentoxy]phenyl]sulfonylamino]propionic acid Formula: C25H29N3O5S MolecularWeight: 483.57986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)O)NS(=O)(=O)C2=CC=CC(=C2)OCCCCCNC3=CC=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)O)NS(=O)(=O)C2=CC=CC(=C2)OCCCCCNC3=CC=CC=N3

InChI

InChI=1S/C25H29N3O5S/c29-25(30)19-23(20-10-3-1-4-11-20)28-34(31,32)22-13-9-12-21(18-22)33-17-8-2-6-15-26-24-14-5-7-16-27-24/h1,3-5,7,9-14,16,18,23,28H,2,6,8,15,17,19H2,(H,26,27)(H,29,30)