tert-butyl 4-(4-methylcyclohexyl)-4-oxidanylidene-but-2-ynoate

Systemtic Name: tert-butyl 4-(4-methylcyclohexyl)-4-oxidanylidene-but-2-ynoate Openeye Name: tert-butyl 4-(4-methylcyclohexyl)-4-oxo-but-2-ynoate CAS Name: 4-(4-methylcyclohexyl)-4-oxo-2-butynoic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-methylcyclohexyl)-4-oxobut-2-ynoate Traditional Name: 4-keto-4-(4-methylcyclohexyl)but-2-ynoic acid tert-butyl ester Formula: C15H22O3 MolecularWeight: 250.33338

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C(=O)C#CC(=O)OC(C)(C)C

Isomeric SMILES

CC1CCC(CC1)C(=O)C#CC(=O)OC(C)(C)C

InChI

InChI=1S/C15H22O3/c1-11-5-7-12(8-6-11)13(16)9-10-14(17)18-15(2,3)4/h11-12H,5-8H2,1-4H3