2-[2-oxidanylidene-5-(phenylmethyl)cyclohexyl]ethanoic acid

Systemtic Name: 2-[2-oxidanylidene-5-(phenylmethyl)cyclohexyl]ethanoic acid Openeye Name: 2-(5-benzyl-2-oxo-cyclohexyl)acetic acid CAS Name: 2-[2-oxo-5-(phenylmethyl)cyclohexyl]acetic acid IUPAC Name: 2-(5-benzyl-2-oxocyclohexyl)acetic acid Traditional Name: 2-(5-benzyl-2-keto-cyclohexyl)acetic acid Formula: C15H18O3 MolecularWeight: 246.30162

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C(CC1CC2=CC=CC=C2)CC(=O)O

Isomeric SMILES

C1CC(=O)C(CC1CC2=CC=CC=C2)CC(=O)O

InChI

InChI=1S/C15H18O3/c16-14-7-6-12(9-13(14)10-15(17)18)8-11-4-2-1-3-5-11/h1-5,12-13H,6-10H2,(H,17,18)