2,3-bis(oxidanyl)butanedioic acid; [(Z)-octadec-9-enyl] 2-piperazin-1-ylethanoate

Systemtic Name: 2,3-bis(oxidanyl)butanedioic acid; [(Z)-octadec-9-enyl] 2-piperazin-1-ylethanoate Openeye Name: 2,3-dihydroxybutanedioic acid; [(Z)-octadec-9-enyl] 2-piperazin-1-ylacetate CAS Name: 2,3-dihydroxybutanedioic acid; 2-(1-piperazinyl)acetic acid [(Z)-octadec-9-enyl] ester IUPAC Name: 2,3-dihydroxybutanedioic acid; [(Z)-octadec-9-enyl] 2-piperazin-1-ylacetate Traditional Name: 2-piperazinoacetic acid [(Z)-octadec-9-enyl] ester; tartaric acid Formula: C32H58N2O14 MolecularWeight: 694.80792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOC(=O)CN1CCNCC1.C(C(C(=O)O)O)(C(=O)O)O.C(C(C(=O)O)O)(C(=O)O)O

Isomeric SMILES

CCCCCCCC/C=C\CCCCCCCCOC(=O)CN1CCNCC1.C(C(C(=O)O)O)(C(=O)O)O.C(C(C(=O)O)O)(C(=O)O)O

InChI

InChI=1S/C24H46N2O2.2C4H6O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-28-24(27)23-26-20-18-25-19-21-26;2*5-1(3(7)8)2(6)4(9)10/h9-10,25H,2-8,11-23H2,1H3;2*1-2,5-6H,(H,7,8)(H,9,10)/b10-9-;;