(phenylmethyl) 3-oxidanylidene-2-[(2-oxidanylidenecyclohexyl)methyl]butanoate

Systemtic Name: (phenylmethyl) 3-oxidanylidene-2-[(2-oxidanylidenecyclohexyl)methyl]butanoate Openeye Name: benzyl 3-oxo-2-[(2-oxocyclohexyl)methyl]butanoate CAS Name: 3-oxo-2-[(2-oxocyclohexyl)methyl]butanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-oxo-2-[(2-oxocyclohexyl)methyl]butanoate Traditional Name: 3-keto-2-[(2-ketocyclohexyl)methyl]butyric acid benzyl ester Formula: C18H22O4 MolecularWeight: 302.36488

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC1CCCCC1=O)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)C(CC1CCCCC1=O)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H22O4/c1-13(19)16(11-15-9-5-6-10-17(15)20)18(21)22-12-14-7-3-2-4-8-14/h2-4,7-8,15-16H,5-6,9-12H2,1H3