[2-(1-adamantyl)-2-oxidanylidene-ethyl] (2S)-2-methylpentanoate

Systemtic Name: [2-(1-adamantyl)-2-oxidanylidene-ethyl] (2S)-2-methylpentanoate Openeye Name: [2-(1-adamantyl)-2-oxo-ethyl] (2S)-2-methylpentanoate CAS Name: (2S)-2-methylpentanoic acid [2-(1-adamantyl)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantyl)-2-oxoethyl] (2S)-2-methylpentanoate Traditional Name: (2S)-2-methylvaleric acid [2-(1-adamantyl)-2-keto-ethyl] ester Formula: C18H28O3 MolecularWeight: 292.41312

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C(=O)OCC(=O)C12CC3CC(C1)CC(C3)C2

Isomeric SMILES

CCC[C@H](C)C(=O)OCC(=O)C12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C18H28O3/c1-3-4-12(2)17(20)21-11-16(19)18-8-13-5-14(9-18)7-15(6-13)10-18/h12-15H,3-11H2,1-2H3/t12-,13?,14?,15?,18?/m0/s1