[(3S)-4-oxidanylidenespiro[4.5]decan-3-yl] benzoate

Systemtic Name: [(3S)-4-oxidanylidenespiro[4.5]decan-3-yl] benzoate Openeye Name: [(3S)-4-oxospiro[4.5]decan-3-yl] benzoate CAS Name: benzoic acid [(3S)-4-oxo-3-spiro[4.5]decanyl] ester IUPAC Name: [(3S)-4-oxospiro[4.5]decan-3-yl] benzoate Traditional Name: benzoic acid [(3S)-4-ketospiro[4.5]decan-3-yl] ester Formula: C17H20O3 MolecularWeight: 272.3389

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)CCC(C2=O)OC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCC2(CC1)CC[C@@H](C2=O)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H20O3/c18-15-14(9-12-17(15)10-5-2-6-11-17)20-16(19)13-7-3-1-4-8-13/h1,3-4,7-8,14H,2,5-6,9-12H2/t14-/m0/s1