1-(2-dodecylsulfanyl-3-propan-2-yloxy-propyl)imidazole; ethanedioic acid

Systemtic Name: 1-(2-dodecylsulfanyl-3-propan-2-yloxy-propyl)imidazole; ethanedioic acid Openeye Name: 1-(2-dodecylsulfanyl-3-isopropoxy-propyl)imidazole; oxalic acid CAS Name: 1-[2-(dodecylthio)-3-propan-2-yloxypropyl]imidazole; oxalic acid IUPAC Name: 1-(2-dodecylsulfanyl-3-propan-2-yloxypropyl)imidazole; oxalic acid Traditional Name: 1-[3-isopropoxy-2-(laurylthio)propyl]imidazole; oxalic acid Formula: C23H42N2O5S MolecularWeight: 458.65498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC(CN1C=CN=C1)COC(C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCCCCCCCCCSC(CN1C=CN=C1)COC(C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H40N2OS.C2H2O4/c1-4-5-6-7-8-9-10-11-12-13-16-25-21(18-24-20(2)3)17-23-15-14-22-19-23;3-1(4)2(5)6/h14-15,19-21H,4-13,16-18H2,1-3H3;(H,3,4)(H,5,6)