2-ethyl-2-methyl-5-[3-(4-pentylphenyl)phenyl]pentanoate

Systemtic Name: 2-ethyl-2-methyl-5-[3-(4-pentylphenyl)phenyl]pentanoate Openeye Name: 2-ethyl-2-methyl-5-[3-(4-pentylphenyl)phenyl]pentanoate CAS Name: 2-ethyl-2-methyl-5-[3-(4-pentylphenyl)phenyl]pentanoate IUPAC Name: 2-ethyl-2-methyl-5-[3-(4-pentylphenyl)phenyl]pentanoate Traditional Name: 5-[3-(4-amylphenyl)phenyl]-2-ethyl-2-methyl-valerate Formula: C25H33O2- MolecularWeight: 365.52832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=CC(=CC=C2)CCCC(C)(CC)C(=O)[O-]

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=CC(=CC=C2)CCCC(C)(CC)C(=O)[O-]

InChI

InChI=1S/C25H34O2/c1-4-6-7-10-20-14-16-22(17-15-20)23-13-8-11-21(19-23)12-9-18-25(3,5-2)24(26)27/h8,11,13-17,19H,4-7,9-10,12,18H2,1-3H3,(H,26,27)/p-1