tert-butyl 5-[3-(2-cyano-3-oxidanylidene-cyclopentyl)propyl]thiophene-2-carboxylate

Systemtic Name: tert-butyl 5-[3-(2-cyano-3-oxidanylidene-cyclopentyl)propyl]thiophene-2-carboxylate Openeye Name: tert-butyl 5-[3-(2-cyano-3-oxo-cyclopentyl)propyl]thiophene-2-carboxylate CAS Name: 5-[3-(2-cyano-3-oxocyclopentyl)propyl]-2-thiophenecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-[3-(2-cyano-3-oxocyclopentyl)propyl]thiophene-2-carboxylate Traditional Name: 5-[3-(2-cyano-3-keto-cyclopentyl)propyl]thiophene-2-carboxylic acid tert-butyl ester Formula: C18H23NO3S MolecularWeight: 333.44512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC=C(S1)CCCC2CCC(=O)C2C#N

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC=C(S1)CCCC2CCC(=O)C2C#N

InChI

InChI=1S/C18H23NO3S/c1-18(2,3)22-17(21)16-10-8-13(23-16)6-4-5-12-7-9-15(20)14(12)11-19/h8,10,12,14H,4-7,9H2,1-3H3