3-[5-[(2,6-dimethoxyphenyl)carbonylamino]benzimidazol-1-yl]-3-phenyl-propanoic acid

Systemtic Name: 3-[5-[(2,6-dimethoxyphenyl)carbonylamino]benzimidazol-1-yl]-3-phenyl-propanoic acid Openeye Name: 3-[5-[(2,6-dimethoxybenzoyl)amino]benzimidazol-1-yl]-3-phenyl-propanoic acid CAS Name: 3-[5-[[(2,6-dimethoxyphenyl)-oxomethyl]amino]-1-benzimidazolyl]-3-phenylpropanoic acid IUPAC Name: 3-[5-[(2,6-dimethoxybenzoyl)amino]benzimidazol-1-yl]-3-phenylpropanoic acid Traditional Name: 3-[5-[(2,6-dimethoxybenzoyl)amino]benzimidazol-1-yl]-3-phenyl-propionic acid Formula: C25H23N3O5 MolecularWeight: 445.46722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(=O)NC2=CC3=C(C=C2)N(C=N3)C(CC(=O)O)C4=CC=CC=C4

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(=O)NC2=CC3=C(C=C2)N(C=N3)C(CC(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C25H23N3O5/c1-32-21-9-6-10-22(33-2)24(21)25(31)27-17-11-12-19-18(13-17)26-15-28(19)20(14-23(29)30)16-7-4-3-5-8-16/h3-13,15,20H,14H2,1-2H3,(H,27,31)(H,29,30)