2,3-bis(oxidanyl)-2,3-bis(phenylcarbonyl)butanedioic acid; 6-ethyl-2-phenyl-piperidin-3-amine

Systemtic Name: 2,3-bis(oxidanyl)-2,3-bis(phenylcarbonyl)butanedioic acid; 6-ethyl-2-phenyl-piperidin-3-amine Openeye Name: 2,3-dibenzoyl-2,3-dihydroxy-butanedioic acid; 6-ethyl-2-phenyl-piperidin-3-amine CAS Name: 2,3-dibenzoyl-2,3-dihydroxybutanedioic acid; 6-ethyl-2-phenyl-3-piperidinamine IUPAC Name: 2,3-dibenzoyl-2,3-dihydroxybutanedioic acid; 6-ethyl-2-phenylpiperidin-3-amine Traditional Name: 2,3-dibenzoyl-2,3-dihydroxy-succinic acid; (6-ethyl-2-phenyl-3-piperidyl)amine Formula: C31H34N2O8 MolecularWeight: 562.61026

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(C(N1)C2=CC=CC=C2)N.C1=CC=C(C=C1)C(=O)C(C(=O)O)(C(C(=O)C2=CC=CC=C2)(C(=O)O)O)O

Isomeric SMILES

CCC1CCC(C(N1)C2=CC=CC=C2)N.C1=CC=C(C=C1)C(=O)C(C(=O)O)(C(C(=O)C2=CC=CC=C2)(C(=O)O)O)O

InChI

InChI=1S/C18H14O8.C13H20N2/c19-13(11-7-3-1-4-8-11)17(25,15(21)22)18(26,16(23)24)14(20)12-9-5-2-6-10-12;1-2-11-8-9-12(14)13(15-11)10-6-4-3-5-7-10/h1-10,25-26H,(H,21,22)(H,23,24);3-7,11-13,15H,2,8-9,14H2,1H3