methyl 3-(2-heptan-2-ylphenyl)propanoate

Systemtic Name: methyl 3-(2-heptan-2-ylphenyl)propanoate Openeye Name: methyl 3-[2-(1-methylhexyl)phenyl]propanoate CAS Name: 3-(2-heptan-2-ylphenyl)propanoic acid methyl ester IUPAC Name: methyl 3-(2-heptan-2-ylphenyl)propanoate Traditional Name: 3-[2-(1-methylhexyl)phenyl]propionic acid methyl ester Formula: C17H26O2 MolecularWeight: 262.38714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)C1=CC=CC=C1CCC(=O)OC

Isomeric SMILES

CCCCCC(C)C1=CC=CC=C1CCC(=O)OC

InChI

InChI=1S/C17H26O2/c1-4-5-6-9-14(2)16-11-8-7-10-15(16)12-13-17(18)19-3/h7-8,10-11,14H,4-6,9,12-13H2,1-3H3