[6-(phenylcarbonyloxy)-5,5-dipropyl-nonan-4-yl] benzoate

Systemtic Name: [6-(phenylcarbonyloxy)-5,5-dipropyl-nonan-4-yl] benzoate Openeye Name: (3-benzoyloxy-1,2,2-tripropyl-hexyl) benzoate CAS Name: benzoic acid (6-benzoyloxy-5,5-dipropylnonan-4-yl) ester IUPAC Name: (6-benzoyloxy-5,5-dipropylnonan-4-yl) benzoate Traditional Name: benzoic acid (3-benzoyloxy-1,2,2-tripropyl-hexyl) ester Formula: C29H40O4 MolecularWeight: 452.6255

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CCC)(CCC)C(CCC)OC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCC(C(CCC)(CCC)C(CCC)OC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C29H40O4/c1-5-15-25(32-27(30)23-17-11-9-12-18-23)29(21-7-3,22-8-4)26(16-6-2)33-28(31)24-19-13-10-14-20-24/h9-14,17-20,25-26H,5-8,15-16,21-22H2,1-4H3