N-[3-[(3-chlorophenyl)carbamoyl-(4-phenoxyphenyl)amino]propyl]-2-fluoranyl-benzamide

Systemtic Name: N-[3-[(3-chlorophenyl)carbamoyl-(4-phenoxyphenyl)amino]propyl]-2-fluoranyl-benzamide Openeye Name: N-[3-[N-[(3-chlorophenyl)carbamoyl]-4-phenoxy-anilino]propyl]-2-fluoro-benzamide CAS Name: N-[3-(N-[(3-chloroanilino)-oxomethyl]-4-phenoxyanilino)propyl]-2-fluorobenzamide IUPAC Name: N-[3-[N-[(3-chlorophenyl)carbamoyl]-4-phenoxyanilino]propyl]-2-fluorobenzamide Traditional Name: N-[3-[N-[(3-chlorophenyl)carbamoyl]-4-phenoxy-anilino]propyl]-2-fluoro-benzamide Formula: C29H25ClFN3O3 MolecularWeight: 517.978503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)N(CCCNC(=O)C3=CC=CC=C3F)C(=O)NC4=CC(=CC=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)N(CCCNC(=O)C3=CC=CC=C3F)C(=O)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C29H25ClFN3O3/c30-21-8-6-9-22(20-21)33-29(36)34(19-7-18-32-28(35)26-12-4-5-13-27(26)31)23-14-16-25(17-15-23)37-24-10-2-1-3-11-24/h1-6,8-17,20H,7,18-19H2,(H,32,35)(H,33,36)