(7-ethyl-2-methyl-undecan-4-yl) benzoate

Systemtic Name: (7-ethyl-2-methyl-undecan-4-yl) benzoate Openeye Name: (4-ethyl-1-isobutyl-octyl) benzoate CAS Name: benzoic acid (7-ethyl-2-methylundecan-4-yl) ester IUPAC Name: (7-ethyl-2-methylundecan-4-yl) benzoate Traditional Name: benzoic acid (4-ethyl-1-isobutyl-octyl) ester Formula: C21H34O2 MolecularWeight: 318.49346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H34O2/c1-5-7-11-18(6-2)14-15-20(16-17(3)4)23-21(22)19-12-9-8-10-13-19/h8-10,12-13,17-18,20H,5-7,11,14-16H2,1-4H3