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

Systemtic Name: [4-[4-(1-dodecoxyethyl)phenyl]phenyl] 4-butylbenzoate Openeye Name: [4-[4-(1-dodecoxyethyl)phenyl]phenyl] 4-butylbenzoate CAS Name: 4-butylbenzoic acid [4-[4-(1-dodecoxyethyl)phenyl]phenyl] ester IUPAC Name: [4-[4-(1-dodecoxyethyl)phenyl]phenyl] 4-butylbenzoate Traditional Name: 4-butylbenzoic acid [4-[4-(1-lauryloxyethyl)phenyl]phenyl] ester Formula: C37H50O3 MolecularWeight: 542.7911

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCC

Isomeric SMILES

CCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCC

InChI

InChI=1S/C37H50O3/c1-4-6-8-9-10-11-12-13-14-15-29-39-30(3)32-21-23-33(24-22-32)34-25-27-36(28-26-34)40-37(38)35-19-17-31(18-20-35)16-7-5-2/h17-28,30H,4-16,29H2,1-3H3