2,3-bis(oxidanyl)butanedioic acid; 3-[1-[2-(6-chloranyl-2-methyl-3H-1,4-benzodioxin-2-yl)-2-oxidanyl-ethyl]piperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 2,3-bis(oxidanyl)butanedioic acid; 3-[1-[2-(6-chloranyl-2-methyl-3H-1,4-benzodioxin-2-yl)-2-oxidanyl-ethyl]piperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[2-(6-chloro-2-methyl-3H-1,4-benzodioxin-2-yl)-2-hydroxy-ethyl]-4-piperidyl]-1H-benzimidazol-2-one; 2,3-dihydroxybutanedioic acid CAS Name: 3-[1-[2-(6-chloro-2-methyl-3H-1,4-benzodioxin-2-yl)-2-hydroxyethyl]-4-piperidinyl]-1H-benzimidazol-2-one; 2,3-dihydroxybutanedioic acid IUPAC Name: 3-[1-[2-(6-chloro-2-methyl-3H-1,4-benzodioxin-2-yl)-2-hydroxyethyl]piperidin-4-yl]-1H-benzimidazol-2-one; 2,3-dihydroxybutanedioic acid Traditional Name: 3-[1-[2-(6-chloro-2-methyl-3H-1,4-benzodioxin-2-yl)-2-hydroxy-ethyl]-4-piperidyl]-1H-benzimidazol-2-one; tartaric acid Formula: C27H32ClN3O10 MolecularWeight: 594.01008

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(O1)C=CC(=C2)Cl)C(CN3CCC(CC3)N4C5=CC=CC=C5NC4=O)O.C(C(C(=O)O)O)(C(=O)O)O

Isomeric SMILES

CC1(COC2=C(O1)C=CC(=C2)Cl)C(CN3CCC(CC3)N4C5=CC=CC=C5NC4=O)O.C(C(C(=O)O)O)(C(=O)O)O

InChI

InChI=1S/C23H26ClN3O4.C4H6O6/c1-23(14-30-20-12-15(24)6-7-19(20)31-23)21(28)13-26-10-8-16(9-11-26)27-18-5-3-2-4-17(18)25-22(27)29;5-1(3(7)8)2(6)4(9)10/h2-7,12,16,21,28H,8-11,13-14H2,1H3,(H,25,29);1-2,5-6H,(H,7,8)(H,9,10)