ethyl 4-[[4-[5-(pyridin-3-ylmethylcarbamoyl)benzimidazol-1-yl]phenoxy]methyl]benzoate

Systemtic Name: ethyl 4-[[4-[5-(pyridin-3-ylmethylcarbamoyl)benzimidazol-1-yl]phenoxy]methyl]benzoate Openeye Name: ethyl 4-[[4-[5-(3-pyridylmethylcarbamoyl)benzimidazol-1-yl]phenoxy]methyl]benzoate CAS Name: 4-[[4-[5-[oxo-(3-pyridinylmethylamino)methyl]-1-benzimidazolyl]phenoxy]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-[5-(pyridin-3-ylmethylcarbamoyl)benzimidazol-1-yl]phenoxy]methyl]benzoate Traditional Name: 4-[[4-[5-(3-pyridylmethylcarbamoyl)benzimidazol-1-yl]phenoxy]methyl]benzoic acid ethyl ester Formula: C30H26N4O4 MolecularWeight: 506.55184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)COC2=CC=C(C=C2)N3C=NC4=C3C=CC(=C4)C(=O)NCC5=CN=CC=C5

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)COC2=CC=C(C=C2)N3C=NC4=C3C=CC(=C4)C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C30H26N4O4/c1-2-37-30(36)23-7-5-21(6-8-23)19-38-26-12-10-25(11-13-26)34-20-33-27-16-24(9-14-28(27)34)29(35)32-18-22-4-3-15-31-17-22/h3-17,20H,2,18-19H2,1H3,(H,32,35)