(4-octan-2-yloxycarbonylphenyl) 4-(12-bromanyldodecoxy)benzoate

Systemtic Name: (4-octan-2-yloxycarbonylphenyl) 4-(12-bromanyldodecoxy)benzoate Openeye Name: [4-(1-methylheptoxycarbonyl)phenyl] 4-(12-bromododecoxy)benzoate CAS Name: 4-(12-bromododecoxy)benzoic acid [4-[octan-2-yloxy(oxo)methyl]phenyl] ester IUPAC Name: (4-octan-2-yloxycarbonylphenyl) 4-(12-bromododecoxy)benzoate Traditional Name: 4-(12-bromododecoxy)benzoic acid [4-(1-methylheptoxycarbonyl)phenyl] ester Formula: C34H49BrO5 MolecularWeight: 617.65386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCCCCCCCCCCCBr

Isomeric SMILES

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCCCCCCCCCCCBr

InChI

InChI=1S/C34H49BrO5/c1-3-4-5-14-17-28(2)39-33(36)29-20-24-32(25-21-29)40-34(37)30-18-22-31(23-19-30)38-27-16-13-11-9-7-6-8-10-12-15-26-35/h18-25,28H,3-17,26-27H2,1-2H3