cyclooctyl 3-cyano-2-methylsulfanyl-4-oxidanylidene-quinolizine-1-carboxylate

Systemtic Name: cyclooctyl 3-cyano-2-methylsulfanyl-4-oxidanylidene-quinolizine-1-carboxylate Openeye Name: cyclooctyl 3-cyano-2-methylsulfanyl-4-oxo-quinolizine-1-carboxylate CAS Name: 3-cyano-2-(methylthio)-4-oxo-1-quinolizinecarboxylic acid cyclooctyl ester IUPAC Name: cyclooctyl 3-cyano-2-methylsulfanyl-4-oxoquinolizine-1-carboxylate Traditional Name: 3-cyano-4-keto-2-(methylthio)quinolizine-1-carboxylic acid cyclooctyl ester Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=O)N2C=CC=CC2=C1C(=O)OC3CCCCCCC3)C#N

Isomeric SMILES

CSC1=C(C(=O)N2C=CC=CC2=C1C(=O)OC3CCCCCCC3)C#N

InChI

InChI=1S/C20H22N2O3S/c1-26-18-15(13-21)19(23)22-12-8-7-11-16(22)17(18)20(24)25-14-9-5-3-2-4-6-10-14/h7-8,11-12,14H,2-6,9-10H2,1H3