3-(2-azanylethanoylamino)-5-[2-(5-chloranyl-2-phenylmethoxy-phenyl)phenyl]benzoic acid

Systemtic Name: 3-(2-azanylethanoylamino)-5-[2-(5-chloranyl-2-phenylmethoxy-phenyl)phenyl]benzoic acid Openeye Name: 3-[(2-aminoacetyl)amino]-5-[2-(2-benzyloxy-5-chloro-phenyl)phenyl]benzoic acid CAS Name: 3-[(2-amino-1-oxoethyl)amino]-5-[2-(5-chloro-2-phenylmethoxyphenyl)phenyl]benzoic acid IUPAC Name: 3-[(2-aminoacetyl)amino]-5-[2-(5-chloro-2-phenylmethoxyphenyl)phenyl]benzoic acid Traditional Name: 3-[2-(2-benzoxy-5-chloro-phenyl)phenyl]-5-(glycylamino)benzoic acid Formula: C28H23ClN2O4 MolecularWeight: 486.94622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)C3=CC=CC=C3C4=CC(=CC(=C4)NC(=O)CN)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)Cl)C3=CC=CC=C3C4=CC(=CC(=C4)NC(=O)CN)C(=O)O

InChI

InChI=1S/C28H23ClN2O4/c29-21-10-11-26(35-17-18-6-2-1-3-7-18)25(15-21)24-9-5-4-8-23(24)19-12-20(28(33)34)14-22(13-19)31-27(32)16-30/h1-15H,16-17,30H2,(H,31,32)(H,33,34)