methyl (2R)-2-ethanoyl-2-[(1R)-3-oxidanylidenecycloheptyl]pent-4-ynoate

Systemtic Name: methyl (2R)-2-ethanoyl-2-[(1R)-3-oxidanylidenecycloheptyl]pent-4-ynoate Openeye Name: methyl (2R)-2-acetyl-2-[(1R)-3-oxocycloheptyl]pent-4-ynoate CAS Name: (2R)-2-acetyl-2-[(1R)-3-oxocycloheptyl]-4-pentynoic acid methyl ester IUPAC Name: methyl (2R)-2-acetyl-2-[(1R)-3-oxocycloheptyl]pent-4-ynoate Traditional Name: (2R)-2-acetyl-2-[(1R)-3-ketocycloheptyl]pent-4-ynoic acid methyl ester Formula: C15H20O4 MolecularWeight: 264.3169

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC#C)(C1CCCCC(=O)C1)C(=O)OC

Isomeric SMILES

CC(=O)[C@@](CC#C)([C@@H]1CCCCC(=O)C1)C(=O)OC

InChI

InChI=1S/C15H20O4/c1-4-9-15(11(2)16,14(18)19-3)12-7-5-6-8-13(17)10-12/h1,12H,5-10H2,2-3H3/t12-,15+/m1/s1