2-[(2-pyridin-4-yl-3H-benzimidazol-5-yl)carbonylamino]-3-(3,4,5-trimethoxyphenyl)propanoic acid

Systemtic Name: 2-[(2-pyridin-4-yl-3H-benzimidazol-5-yl)carbonylamino]-3-(3,4,5-trimethoxyphenyl)propanoic acid Openeye Name: 2-[[2-(4-pyridyl)-3H-benzimidazole-5-carbonyl]amino]-3-(3,4,5-trimethoxyphenyl)propanoic acid CAS Name: 2-[[oxo-(2-pyridin-4-yl-3H-benzimidazol-5-yl)methyl]amino]-3-(3,4,5-trimethoxyphenyl)propanoic acid IUPAC Name: 2-[(2-pyridin-4-yl-3H-benzimidazole-5-carbonyl)amino]-3-(3,4,5-trimethoxyphenyl)propanoic acid Traditional Name: 2-[[2-(4-pyridyl)-3H-benzimidazole-5-carbonyl]amino]-3-(3,4,5-trimethoxyphenyl)propionic acid Formula: C25H24N4O6 MolecularWeight: 476.48126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H24N4O6/c1-33-20-11-14(12-21(34-2)22(20)35-3)10-19(25(31)32)29-24(30)16-4-5-17-18(13-16)28-23(27-17)15-6-8-26-9-7-15/h4-9,11-13,19H,10H2,1-3H3,(H,27,28)(H,29,30)(H,31,32)