ethyl 8-cyano-2-(2,2-diethoxyethylsulfanyl)oct-4-ynoate

Systemtic Name: ethyl 8-cyano-2-(2,2-diethoxyethylsulfanyl)oct-4-ynoate Openeye Name: ethyl 8-cyano-2-(2,2-diethoxyethylsulfanyl)oct-4-ynoate CAS Name: 8-cyano-2-(2,2-diethoxyethylthio)-4-octynoic acid ethyl ester IUPAC Name: ethyl 8-cyano-2-(2,2-diethoxyethylsulfanyl)oct-4-ynoate Traditional Name: 8-cyano-2-(2,2-diethoxyethylthio)oct-4-ynoic acid ethyl ester Formula: C17H27NO4S MolecularWeight: 341.46558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CSC(CC#CCCCC#N)C(=O)OCC)OCC

Isomeric SMILES

CCOC(CSC(CC#CCCCC#N)C(=O)OCC)OCC

InChI

InChI=1S/C17H27NO4S/c1-4-20-16(21-5-2)14-23-15(17(19)22-6-3)12-10-8-7-9-11-13-18/h15-16H,4-7,9,11-12,14H2,1-3H3