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2-(3,7-dimethyloct-6-enylsulfinyl)-1H-benzimidazole; ethanedioic acid

2-(3,7-dimethyloct-6-enylsulfinyl)-1H-benzimidazole; ethanedioic acid

Systemtic Name:2-(3,7-dimethyloct-6-enylsulfinyl)-1H-benzimidazole; ethanedioic acid
Openeye Name:2-(3,7-dimethyloct-6-enylsulfinyl)-1H-benzimidazole; oxalic acid
CAS Name:2-(3,7-dimethyloct-6-enylsulfinyl)-1H-benzimidazole; oxalic acid
IUPAC Name:2-(3,7-dimethyloct-6-enylsulfinyl)-1H-benzimidazole; oxalic acid
Traditional Name:2-(3,7-dimethyloct-6-enylsulfinyl)-1H-benzimidazole; oxalic acid
Formula: C19H26N2O5S
MolecularWeight: 394.48514
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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC=C(C)C)CCS(=O)C1=NC2=CC=CC=C2N1.C(=O)(C(=O)O)O


Isomeric SMILES

CC(CCC=C(C)C)CCS(=O)C1=NC2=CC=CC=C2N1.C(=O)(C(=O)O)O


InChI

InChI=1S/C17H24N2OS.C2H2O4/c1-13(2)7-6-8-14(3)11-12-21(20)17-18-15-9-4-5-10-16(15)19-17;3-1(4)2(5)6/h4-5,7,9-10,14H,6,8,11-12H2,1-3H3,(H,18,19);(H,3,4)(H,5,6)


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