2-[[5-chloranyl-2-(naphthalen-2-ylsulfonylamino)phenyl]carbonylamino]-3-[4-(2-phenoxyphenyl)phenyl]propanoic acid

Systemtic Name: 2-[[5-chloranyl-2-(naphthalen-2-ylsulfonylamino)phenyl]carbonylamino]-3-[4-(2-phenoxyphenyl)phenyl]propanoic acid Openeye Name: 2-[[5-chloro-2-(2-naphthylsulfonylamino)benzoyl]amino]-3-[4-(2-phenoxyphenyl)phenyl]propanoic acid CAS Name: 2-[[[5-chloro-2-(2-naphthalenylsulfonylamino)phenyl]-oxomethyl]amino]-3-[4-(2-phenoxyphenyl)phenyl]propanoic acid IUPAC Name: 2-[[5-chloro-2-(naphthalen-2-ylsulfonylamino)benzoyl]amino]-3-[4-(2-phenoxyphenyl)phenyl]propanoic acid Traditional Name: 2-[[5-chloro-2-(2-naphthylsulfonylamino)benzoyl]amino]-3-[4-(2-phenoxyphenyl)phenyl]propionic acid Formula: C38H29ClN2O6S MolecularWeight: 677.16466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC=C2C3=CC=C(C=C3)CC(C(=O)O)NC(=O)C4=C(C=CC(=C4)Cl)NS(=O)(=O)C5=CC6=CC=CC=C6C=C5

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC=C2C3=CC=C(C=C3)CC(C(=O)O)NC(=O)C4=C(C=CC(=C4)Cl)NS(=O)(=O)C5=CC6=CC=CC=C6C=C5

InChI

InChI=1S/C38H29ClN2O6S/c39-29-19-21-34(41-48(45,46)31-20-18-26-8-4-5-9-28(26)23-31)33(24-29)37(42)40-35(38(43)44)22-25-14-16-27(17-15-25)32-12-6-7-13-36(32)47-30-10-2-1-3-11-30/h1-21,23-24,35,41H,22H2,(H,40,42)(H,43,44)