tert-butyl 4-methyl-7-oxidanylidene-2-(3-phenylpropyl)heptanoate

Systemtic Name: tert-butyl 4-methyl-7-oxidanylidene-2-(3-phenylpropyl)heptanoate Openeye Name: tert-butyl 4-methyl-7-oxo-2-(3-phenylpropyl)heptanoate CAS Name: 4-methyl-7-oxo-2-(3-phenylpropyl)heptanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-methyl-7-oxo-2-(3-phenylpropyl)heptanoate Traditional Name: 7-keto-4-methyl-2-(3-phenylpropyl)enanthic acid tert-butyl ester Formula: C21H32O3 MolecularWeight: 332.47698

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC=O)CC(CCCC1=CC=CC=C1)C(=O)OC(C)(C)C

Isomeric SMILES

CC(CCC=O)CC(CCCC1=CC=CC=C1)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H32O3/c1-17(10-9-15-22)16-19(20(23)24-21(2,3)4)14-8-13-18-11-6-5-7-12-18/h5-7,11-12,15,17,19H,8-10,13-14,16H2,1-4H3