1,1-bis[4-oxidanyl-3-(phenylcarbonyl)piperidin-4-yl]butane-1,2,3,4-tetracarboxylic acid

Systemtic Name: 1,1-bis[4-oxidanyl-3-(phenylcarbonyl)piperidin-4-yl]butane-1,2,3,4-tetracarboxylic acid Openeye Name: 1,1-bis(3-benzoyl-4-hydroxy-4-piperidyl)butane-1,2,3,4-tetracarboxylic acid CAS Name: 1,1-bis(3-benzoyl-4-hydroxy-4-piperidinyl)butane-1,2,3,4-tetracarboxylic acid IUPAC Name: 1,1-bis(3-benzoyl-4-hydroxypiperidin-4-yl)butane-1,2,3,4-tetracarboxylic acid Traditional Name: 1,1-bis(3-benzoyl-4-hydroxy-4-piperidyl)butane-1,2,3,4-tetracarboxylic acid Formula: C32H36N2O12 MolecularWeight: 640.63444

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC(C1(C(C(C(CC(=O)O)C(=O)O)C(=O)O)(C(=O)O)C2(CCNCC2C(=O)C3=CC=CC=C3)O)O)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CNCC(C1(C(C(C(CC(=O)O)C(=O)O)C(=O)O)(C(=O)O)C2(CCNCC2C(=O)C3=CC=CC=C3)O)O)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C32H36N2O12/c35-23(36)15-20(27(39)40)24(28(41)42)32(29(43)44,30(45)11-13-33-16-21(30)25(37)18-7-3-1-4-8-18)31(46)12-14-34-17-22(31)26(38)19-9-5-2-6-10-19/h1-10,20-22,24,33-34,45-46H,11-17H2,(H,35,36)(H,39,40)(H,41,42)(H,43,44)