tert-butyl 3-oxidanylidene-2-[(2-oxidanylidenecyclohexyl)-phenyl-methyl]butanoate

Systemtic Name: tert-butyl 3-oxidanylidene-2-[(2-oxidanylidenecyclohexyl)-phenyl-methyl]butanoate Openeye Name: tert-butyl 3-oxo-2-[(2-oxocyclohexyl)-phenyl-methyl]butanoate CAS Name: 3-oxo-2-[(2-oxocyclohexyl)-phenylmethyl]butanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-oxo-2-[(2-oxocyclohexyl)-phenylmethyl]butanoate Traditional Name: 3-keto-2-[(2-ketocyclohexyl)-phenyl-methyl]butyric acid tert-butyl ester Formula: C21H28O4 MolecularWeight: 344.44462

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(C1CCCCC1=O)C2=CC=CC=C2)C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)C(C(C1CCCCC1=O)C2=CC=CC=C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H28O4/c1-14(22)18(20(24)25-21(2,3)4)19(15-10-6-5-7-11-15)16-12-8-9-13-17(16)23/h5-7,10-11,16,18-19H,8-9,12-13H2,1-4H3