methyl (2S)-2-ethyl-5-(hydroxymethyl)-2,6-dimethyl-3-oxidanylidene-oct-7-ynoate

Systemtic Name: methyl (2S)-2-ethyl-5-(hydroxymethyl)-2,6-dimethyl-3-oxidanylidene-oct-7-ynoate Openeye Name: methyl (2S)-2-ethyl-5-(hydroxymethyl)-2,6-dimethyl-3-oxo-oct-7-ynoate CAS Name: (2S)-2-ethyl-5-(hydroxymethyl)-2,6-dimethyl-3-oxo-7-octynoic acid methyl ester IUPAC Name: methyl (2S)-2-ethyl-5-(hydroxymethyl)-2,6-dimethyl-3-oxooct-7-ynoate Traditional Name: (2S)-2-ethyl-3-keto-2,6-dimethyl-5-methylol-oct-7-ynoic acid methyl ester Formula: C14H22O4 MolecularWeight: 254.32208

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(=O)CC(CO)C(C)C#C)C(=O)OC

Isomeric SMILES

CC[C@@](C)(C(=O)CC(CO)C(C)C#C)C(=O)OC

InChI

InChI=1S/C14H22O4/c1-6-10(3)11(9-15)8-12(16)14(4,7-2)13(17)18-5/h1,10-11,15H,7-9H2,2-5H3/t10?,11?,14-/m0/s1