[4-(1-dodecoxyethyl)phenyl] 4-butylbenzoate

Systemtic Name: [4-(1-dodecoxyethyl)phenyl] 4-butylbenzoate Openeye Name: [4-(1-dodecoxyethyl)phenyl] 4-butylbenzoate CAS Name: 4-butylbenzoic acid [4-(1-dodecoxyethyl)phenyl] ester IUPAC Name: [4-(1-dodecoxyethyl)phenyl] 4-butylbenzoate Traditional Name: 4-butylbenzoic acid [4-(1-lauryloxyethyl)phenyl] ester Formula: C31H46O3 MolecularWeight: 466.69514

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H46O3/c1-4-6-8-9-10-11-12-13-14-15-25-33-26(3)28-21-23-30(24-22-28)34-31(32)29-19-17-27(18-20-29)16-7-5-2/h17-24,26H,4-16,25H2,1-3H3