tert-butyl 3-methanoyl-5-methyl-2-(3-phenylpropyl)hexanoate

Systemtic Name: tert-butyl 3-methanoyl-5-methyl-2-(3-phenylpropyl)hexanoate Openeye Name: tert-butyl 3-formyl-5-methyl-2-(3-phenylpropyl)hexanoate CAS Name: 3-formyl-5-methyl-2-(3-phenylpropyl)hexanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-formyl-5-methyl-2-(3-phenylpropyl)hexanoate Traditional Name: 3-formyl-5-methyl-2-(3-phenylpropyl)hexanoic acid tert-butyl ester Formula: C21H32O3 MolecularWeight: 332.47698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H32O3/c1-16(2)14-18(15-22)19(20(23)24-21(3,4)5)13-9-12-17-10-7-6-8-11-17/h6-8,10-11,15-16,18-19H,9,12-14H2,1-5H3