phenyl 4-octan-2-yloxybenzoate

Systemtic Name: phenyl 4-octan-2-yloxybenzoate Openeye Name: phenyl 4-(1-methylheptoxy)benzoate CAS Name: 4-octan-2-yloxybenzoic acid phenyl ester IUPAC Name: phenyl 4-octan-2-yloxybenzoate Traditional Name: 4-(1-methylheptoxy)benzoic acid phenyl ester Formula: C21H26O3 MolecularWeight: 326.42934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2

Isomeric SMILES

CCCCCCC(C)OC1=CC=C(C=C1)C(=O)OC2=CC=CC=C2

InChI

InChI=1S/C21H26O3/c1-3-4-5-7-10-17(2)23-20-15-13-18(14-16-20)21(22)24-19-11-8-6-9-12-19/h6,8-9,11-17H,3-5,7,10H2,1-2H3