[4-(5-butyl-1,3-dioxan-2-yl)phenyl] 4-butylbenzoate

Systemtic Name: [4-(5-butyl-1,3-dioxan-2-yl)phenyl] 4-butylbenzoate Openeye Name: [4-(5-butyl-1,3-dioxan-2-yl)phenyl] 4-butylbenzoate CAS Name: 4-butylbenzoic acid [4-(5-butyl-1,3-dioxan-2-yl)phenyl] ester IUPAC Name: [4-(5-butyl-1,3-dioxan-2-yl)phenyl] 4-butylbenzoate Traditional Name: 4-butylbenzoic acid [4-(5-butyl-1,3-dioxan-2-yl)phenyl] ester Formula: C25H32O4 MolecularWeight: 396.51918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1COC(OC1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCC

Isomeric SMILES

CCCCC1COC(OC1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCC

InChI

InChI=1S/C25H32O4/c1-3-5-7-19-9-11-21(12-10-19)24(26)29-23-15-13-22(14-16-23)25-27-17-20(18-28-25)8-6-4-2/h9-16,20,25H,3-8,17-18H2,1-2H3