ethanedioic acid; 1-(3-hexoxy-2-hexylsulfanyl-propyl)imidazole

Systemtic Name: ethanedioic acid; 1-(3-hexoxy-2-hexylsulfanyl-propyl)imidazole Openeye Name: 1-(3-hexoxy-2-hexylsulfanyl-propyl)imidazole; oxalic acid CAS Name: 1-[3-hexoxy-2-(hexylthio)propyl]imidazole; oxalic acid IUPAC Name: 1-(3-hexoxy-2-hexylsulfanylpropyl)imidazole; oxalic acid Traditional Name: 1-[3-hexoxy-2-(hexylthio)propyl]imidazole; oxalic acid Formula: C20H36N2O5S MolecularWeight: 416.57524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOCC(CN1C=CN=C1)SCCCCCC.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCCCOCC(CN1C=CN=C1)SCCCCCC.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H34N2OS.C2H2O4/c1-3-5-7-9-13-21-16-18(15-20-12-11-19-17-20)22-14-10-8-6-4-2;3-1(4)2(5)6/h11-12,17-18H,3-10,13-16H2,1-2H3;(H,3,4)(H,5,6)