(5S,7S)-3-propan-2-yladamantane-1-carboxylate

Systemtic Name: (5S,7S)-3-propan-2-yladamantane-1-carboxylate Openeye Name: (5S,7S)-3-isopropyladamantane-1-carboxylate CAS Name: (5S,7S)-3-propan-2-yl-1-adamantanecarboxylate IUPAC Name: (5S,7S)-3-propan-2-yladamantane-1-carboxylate Traditional Name: (5S,7S)-3-isopropyladamantane-1-carboxylate Formula: C14H21O2- MolecularWeight: 221.31534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C12CC3CC(C1)CC(C3)(C2)C(=O)[O-]

Isomeric SMILES

CC(C)C12C[C@@H]3C[C@@H](C1)CC(C3)(C2)C(=O)[O-]

InChI

InChI=1S/C14H22O2/c1-9(2)13-4-10-3-11(5-13)7-14(6-10,8-13)12(15)16/h9-11H,3-8H2,1-2H3,(H,15,16)/p-1/t10-,11-,13?,14?/m0/s1