methyl 6-[(1S,2R)-2-(iodanylmethyl)-2-methyl-3-oxidanylidene-cyclopentyl]hex-2-ynoate

Systemtic Name: methyl 6-[(1S,2R)-2-(iodanylmethyl)-2-methyl-3-oxidanylidene-cyclopentyl]hex-2-ynoate Openeye Name: methyl 6-[(1S,2R)-2-(iodomethyl)-2-methyl-3-oxo-cyclopentyl]hex-2-ynoate CAS Name: 6-[(1S,2R)-2-(iodomethyl)-2-methyl-3-oxocyclopentyl]-2-hexynoic acid methyl ester IUPAC Name: methyl 6-[(1S,2R)-2-(iodomethyl)-2-methyl-3-oxocyclopentyl]hex-2-ynoate Traditional Name: 6-[(1S,2R)-2-(iodomethyl)-3-keto-2-methyl-cyclopentyl]hex-2-ynoic acid methyl ester Formula: C14H19IO3 MolecularWeight: 362.20333

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CCC1=O)CCCC#CC(=O)OC)CI

Isomeric SMILES

C[C@]1([C@H](CCC1=O)CCCC#CC(=O)OC)CI

InChI

InChI=1S/C14H19IO3/c1-14(10-15)11(8-9-12(14)16)6-4-3-5-7-13(17)18-2/h11H,3-4,6,8-10H2,1-2H3/t11-,14+/m0/s1