3-phenyl-3-[5-[3-(3,4,5-trimethoxyphenyl)propanoylamino]benzimidazol-1-yl]propanoic acid

Systemtic Name: 3-phenyl-3-[5-[3-(3,4,5-trimethoxyphenyl)propanoylamino]benzimidazol-1-yl]propanoic acid Openeye Name: 3-phenyl-3-[5-[3-(3,4,5-trimethoxyphenyl)propanoylamino]benzimidazol-1-yl]propanoic acid CAS Name: 3-[5-[[1-oxo-3-(3,4,5-trimethoxyphenyl)propyl]amino]-1-benzimidazolyl]-3-phenylpropanoic acid IUPAC Name: 3-phenyl-3-[5-[3-(3,4,5-trimethoxyphenyl)propanoylamino]benzimidazol-1-yl]propanoic acid Traditional Name: 3-phenyl-3-[5-[3-(3,4,5-trimethoxyphenyl)propanoylamino]benzimidazol-1-yl]propionic acid Formula: C28H29N3O6 MolecularWeight: 503.54636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CCC(=O)NC2=CC3=C(C=C2)N(C=N3)C(CC(=O)O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CCC(=O)NC2=CC3=C(C=C2)N(C=N3)C(CC(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C28H29N3O6/c1-35-24-13-18(14-25(36-2)28(24)37-3)9-12-26(32)30-20-10-11-22-21(15-20)29-17-31(22)23(16-27(33)34)19-7-5-4-6-8-19/h4-8,10-11,13-15,17,23H,9,12,16H2,1-3H3,(H,30,32)(H,33,34)