6-methylheptyl 5-phenyl-2-(phenylcarbonyl)benzoate

Systemtic Name: 6-methylheptyl 5-phenyl-2-(phenylcarbonyl)benzoate Openeye Name: 6-methylheptyl 2-benzoyl-5-phenyl-benzoate CAS Name: 2-benzoyl-5-phenylbenzoic acid 6-methylheptyl ester IUPAC Name: 6-methylheptyl 2-benzoyl-5-phenylbenzoate Traditional Name: 2-benzoyl-5-phenyl-benzoic acid 6-methylheptyl ester Formula: C28H30O3 MolecularWeight: 414.536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCOC(=O)C1=C(C=CC(=C1)C2=CC=CC=C2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)CCCCCOC(=O)C1=C(C=CC(=C1)C2=CC=CC=C2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C28H30O3/c1-21(2)12-6-5-11-19-31-28(30)26-20-24(22-13-7-3-8-14-22)17-18-25(26)27(29)23-15-9-4-10-16-23/h3-4,7-10,13-18,20-21H,5-6,11-12,19H2,1-2H3