5-[4-(4-bromophenyl)phenyl]-2-butyl-oxane

Systemtic Name: 5-[4-(4-bromophenyl)phenyl]-2-butyl-oxane Openeye Name: 5-[4-(4-bromophenyl)phenyl]-2-butyl-tetrahydropyran CAS Name: 5-[4-(4-bromophenyl)phenyl]-2-butyloxane IUPAC Name: 5-[4-(4-bromophenyl)phenyl]-2-butyloxane Traditional Name: 5-[4-(4-bromophenyl)phenyl]-2-butyl-tetrahydropyran Formula: C21H25BrO MolecularWeight: 373.3266

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CO1)C2=CC=C(C=C2)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCCC1CCC(CO1)C2=CC=C(C=C2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H25BrO/c1-2-3-4-21-14-11-19(15-23-21)18-7-5-16(6-8-18)17-9-12-20(22)13-10-17/h5-10,12-13,19,21H,2-4,11,14-15H2,1H3