2,3-bis(oxidanyl)butanedioic acid; 6-fluoranyl-2-(piperidin-4-ylmethyl)-1H-benzimidazole

Systemtic Name: 2,3-bis(oxidanyl)butanedioic acid; 6-fluoranyl-2-(piperidin-4-ylmethyl)-1H-benzimidazole Openeye Name: 2,3-dihydroxybutanedioic acid; 6-fluoro-2-(4-piperidylmethyl)-1H-benzimidazole CAS Name: 2,3-dihydroxybutanedioic acid; 6-fluoro-2-(4-piperidinylmethyl)-1H-benzimidazole IUPAC Name: 2,3-dihydroxybutanedioic acid; 6-fluoro-2-(piperidin-4-ylmethyl)-1H-benzimidazole Traditional Name: 6-fluoro-2-(4-piperidylmethyl)-1H-benzimidazole; tartaric acid Formula: C17H22FN3O6 MolecularWeight: 383.371483

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CC2=NC3=C(N2)C=C(C=C3)F.C(C(C(=O)O)O)(C(=O)O)O

Isomeric SMILES

C1CNCCC1CC2=NC3=C(N2)C=C(C=C3)F.C(C(C(=O)O)O)(C(=O)O)O

InChI

InChI=1S/C13H16FN3.C4H6O6/c14-10-1-2-11-12(8-10)17-13(16-11)7-9-3-5-15-6-4-9;5-1(3(7)8)2(6)4(9)10/h1-2,8-9,15H,3-7H2,(H,16,17);1-2,5-6H,(H,7,8)(H,9,10)