[4-[4-(1-butoxyethyl)phenyl]phenyl] 4-hexylbenzoate

Systemtic Name: [4-[4-(1-butoxyethyl)phenyl]phenyl] 4-hexylbenzoate Openeye Name: [4-[4-(1-butoxyethyl)phenyl]phenyl] 4-hexylbenzoate CAS Name: 4-hexylbenzoic acid [4-[4-(1-butoxyethyl)phenyl]phenyl] ester IUPAC Name: [4-[4-(1-butoxyethyl)phenyl]phenyl] 4-hexylbenzoate Traditional Name: 4-hexylbenzoic acid [4-[4-(1-butoxyethyl)phenyl]phenyl] ester Formula: C31H38O3 MolecularWeight: 458.63162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C(C)OCCCC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C(C)OCCCC

InChI

InChI=1S/C31H38O3/c1-4-6-8-9-10-25-11-13-29(14-12-25)31(32)34-30-21-19-28(20-22-30)27-17-15-26(16-18-27)24(3)33-23-7-5-2/h11-22,24H,4-10,23H2,1-3H3