2-(4,5-dipentyl-1,3-dithiol-2-ylidene)-5-methyl-1,3-dithiole-4-carboxylic acid

Systemtic Name: 2-(4,5-dipentyl-1,3-dithiol-2-ylidene)-5-methyl-1,3-dithiole-4-carboxylic acid Openeye Name: 2-(4,5-dipentyl-1,3-dithiol-2-ylidene)-5-methyl-1,3-dithiole-4-carboxylic acid CAS Name: 2-(4,5-dipentyl-1,3-dithiol-2-ylidene)-5-methyl-1,3-dithiole-4-carboxylic acid IUPAC Name: 2-(4,5-dipentyl-1,3-dithiol-2-ylidene)-5-methyl-1,3-dithiole-4-carboxylic acid Traditional Name: 2-(4,5-diamyl-1,3-dithiol-2-ylidene)-5-methyl-1,3-dithiole-4-carboxylic acid Formula: C18H26O2S4 MolecularWeight: 402.65784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(SC(=C2SC(=C(S2)C(=O)O)C)S1)CCCCC

Isomeric SMILES

CCCCCC1=C(SC(=C2SC(=C(S2)C(=O)O)C)S1)CCCCC

InChI

InChI=1S/C18H26O2S4/c1-4-6-8-10-13-14(11-9-7-5-2)23-18(22-13)17-21-12(3)15(24-17)16(19)20/h4-11H2,1-3H3,(H,19,20)