3,6-dipentyl-3,6-dihydro-2H-thiopyran-2-carboxylic acid

Systemtic Name: 3,6-dipentyl-3,6-dihydro-2H-thiopyran-2-carboxylic acid Openeye Name: 3,6-dipentyl-3,6-dihydro-2H-thiopyran-2-carboxylic acid CAS Name: 3,6-dipentyl-3,6-dihydro-2H-thiopyran-2-carboxylic acid IUPAC Name: 3,6-dipentyl-3,6-dihydro-2H-thiopyran-2-carboxylic acid Traditional Name: 3,6-diamyl-3,6-dihydro-2H-thiopyran-2-carboxylic acid Formula: C16H28O2S MolecularWeight: 284.45732

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C=CC(SC1C(=O)O)CCCCC

Isomeric SMILES

CCCCCC1C=CC(SC1C(=O)O)CCCCC

InChI

InChI=1S/C16H28O2S/c1-3-5-7-9-13-11-12-14(10-8-6-4-2)19-15(13)16(17)18/h11-15H,3-10H2,1-2H3,(H,17,18)