2-(aminocarbonylamino)-3-[4-[2-(aminocarbonylamino)-2-methyl-3-oxidanyl-3-oxidanylidene-1-phenoxy-propyl]phenyl]-2-methyl-3-phenoxy-propanoic acid

Systemtic Name: 2-(aminocarbonylamino)-3-[4-[2-(aminocarbonylamino)-2-methyl-3-oxidanyl-3-oxidanylidene-1-phenoxy-propyl]phenyl]-2-methyl-3-phenoxy-propanoic acid Openeye Name: 3-[4-(3-hydroxy-2-methyl-3-oxo-1-phenoxy-2-ureido-propyl)phenyl]-2-methyl-3-phenoxy-2-ureido-propanoic acid CAS Name: 2-(carbamoylamino)-3-[4-[2-(carbamoylamino)-3-hydroxy-2-methyl-3-oxo-1-phenoxypropyl]phenyl]-2-methyl-3-phenoxypropanoic acid IUPAC Name: 2-(carbamoylamino)-3-[4-[2-(carbamoylamino)-3-hydroxy-2-methyl-3-oxo-1-phenoxypropyl]phenyl]-2-methyl-3-phenoxypropanoic acid Traditional Name: 3-[4-(3-hydroxy-3-keto-2-methyl-1-phenoxy-2-ureido-propyl)phenyl]-2-methyl-3-phenoxy-2-ureido-propionic acid Formula: C28H30N4O8 MolecularWeight: 550.5598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=C(C=C1)C(C(C)(C(=O)O)NC(=O)N)OC2=CC=CC=C2)OC3=CC=CC=C3)(C(=O)O)NC(=O)N

Isomeric SMILES

CC(C(C1=CC=C(C=C1)C(C(C)(C(=O)O)NC(=O)N)OC2=CC=CC=C2)OC3=CC=CC=C3)(C(=O)O)NC(=O)N

InChI

InChI=1S/C28H30N4O8/c1-27(23(33)34,31-25(29)37)21(39-19-9-5-3-6-10-19)17-13-15-18(16-14-17)22(40-20-11-7-4-8-12-20)28(2,24(35)36)32-26(30)38/h3-16,21-22H,1-2H3,(H,33,34)(H,35,36)(H3,29,31,37)(H3,30,32,38)