N-(2-dodecylsulfanylethyl)-2-piperidin-1-yl-ethanamide; 2-oxidanylpropane-1,2,3-tricarboxylic acid

Systemtic Name: N-(2-dodecylsulfanylethyl)-2-piperidin-1-yl-ethanamide; 2-oxidanylpropane-1,2,3-tricarboxylic acid Openeye Name: citric acid; N-(2-dodecylsulfanylethyl)-2-(1-piperidyl)acetamide CAS Name: N-[2-(dodecylthio)ethyl]-2-(1-piperidinyl)acetamide; 2-hydroxypropane-1,2,3-tricarboxylic acid IUPAC Name: N-(2-dodecylsulfanylethyl)-2-piperidin-1-ylacetamide; 2-hydroxypropane-1,2,3-tricarboxylic acid Traditional Name: citric acid; N-[2-(laurylthio)ethyl]-2-piperidino-acetamide Formula: C27H50N2O8S MolecularWeight: 562.7595

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSCCNC(=O)CN1CCCCC1.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CCCCCCCCCCCCSCCNC(=O)CN1CCCCC1.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C21H42N2OS.C6H8O7/c1-2-3-4-5-6-7-8-9-10-14-18-25-19-15-22-21(24)20-23-16-12-11-13-17-23;7-3(8)1-6(13,5(11)12)2-4(9)10/h2-20H2,1H3,(H,22,24);13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)