octan-2-yl 4-(4-methoxyphenyl)benzoate

Systemtic Name: octan-2-yl 4-(4-methoxyphenyl)benzoate Openeye Name: 1-methylheptyl 4-(4-methoxyphenyl)benzoate CAS Name: 4-(4-methoxyphenyl)benzoic acid octan-2-yl ester IUPAC Name: octan-2-yl 4-(4-methoxyphenyl)benzoate Traditional Name: 4-(4-methoxyphenyl)benzoic acid 1-methylheptyl ester Formula: C22H28O3 MolecularWeight: 340.45592

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)OC

InChI

InChI=1S/C22H28O3/c1-4-5-6-7-8-17(2)25-22(23)20-11-9-18(10-12-20)19-13-15-21(24-3)16-14-19/h9-17H,4-8H2,1-3H3