[4-(1-octoxyethyl)phenyl] 4-propylbenzoate

Systemtic Name: [4-(1-octoxyethyl)phenyl] 4-propylbenzoate Openeye Name: [4-(1-octoxyethyl)phenyl] 4-propylbenzoate CAS Name: 4-propylbenzoic acid [4-(1-octoxyethyl)phenyl] ester IUPAC Name: [4-(1-octoxyethyl)phenyl] 4-propylbenzoate Traditional Name: 4-propylbenzoic acid [4-(1-octoxyethyl)phenyl] ester Formula: C26H36O3 MolecularWeight: 396.56224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H36O3/c1-4-6-7-8-9-10-20-28-21(3)23-16-18-25(19-17-23)29-26(27)24-14-12-22(11-5-2)13-15-24/h12-19,21H,4-11,20H2,1-3H3