2-oxidanyl-5-[1-oxidanyl-2-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]benzoic acid

Systemtic Name: 2-oxidanyl-5-[1-oxidanyl-2-[4-(2-oxidanylidene-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]benzoic acid Openeye Name: 2-hydroxy-5-[1-hydroxy-2-[4-(2-oxo-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]benzoic acid CAS Name: 2-hydroxy-5-[1-hydroxy-2-[4-(2-oxo-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]benzoic acid IUPAC Name: 2-hydroxy-5-[1-hydroxy-2-[4-(2-oxo-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]benzoic acid Traditional Name: 2-hydroxy-5-[1-hydroxy-2-[4-(2-keto-3H-benzimidazol-1-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]benzoic acid Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC=C1N2C3=CC=CC=C3NC2=O)CC(C4=CC(=C(C=C4)O)C(=O)O)O

Isomeric SMILES

C1CN(CC=C1N2C3=CC=CC=C3NC2=O)CC(C4=CC(=C(C=C4)O)C(=O)O)O

InChI

InChI=1S/C21H21N3O5/c25-18-6-5-13(11-15(18)20(27)28)19(26)12-23-9-7-14(8-10-23)24-17-4-2-1-3-16(17)22-21(24)29/h1-7,11,19,25-26H,8-10,12H2,(H,22,29)(H,27,28)