2-[[4-[phenoxy(phenylsulfonylamino)methyl]phenyl]methoxycarbonylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[4-[phenoxy(phenylsulfonylamino)methyl]phenyl]methoxycarbonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[4-[benzenesulfonamido(phenoxy)methyl]phenyl]methoxycarbonylamino]-3-phenyl-propanoic acid CAS Name: 2-[[[4-[benzenesulfonamido(phenoxy)methyl]phenyl]methoxy-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[4-[benzenesulfonamido(phenoxy)methyl]phenyl]methoxycarbonylamino]-3-phenylpropanoic acid Traditional Name: 2-[[4-[benzenesulfonamido(phenoxy)methyl]benzyl]oxycarbonylamino]-3-phenyl-propionic acid Formula: C30H28N2O7S MolecularWeight: 560.61752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)OCC2=CC=C(C=C2)C(NS(=O)(=O)C3=CC=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)NC(=O)OCC2=CC=C(C=C2)C(NS(=O)(=O)C3=CC=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C30H28N2O7S/c33-29(34)27(20-22-10-4-1-5-11-22)31-30(35)38-21-23-16-18-24(19-17-23)28(39-25-12-6-2-7-13-25)32-40(36,37)26-14-8-3-9-15-26/h1-19,27-28,32H,20-21H2,(H,31,35)(H,33,34)