(4-octan-2-yloxycarbonylphenyl) 4-[4-[(3-methyloxetan-3-yl)methyl]phenyl]benzoate

Systemtic Name: (4-octan-2-yloxycarbonylphenyl) 4-[4-[(3-methyloxetan-3-yl)methyl]phenyl]benzoate Openeye Name: [4-(1-methylheptoxycarbonyl)phenyl] 4-[4-[(3-methyloxetan-3-yl)methyl]phenyl]benzoate CAS Name: 4-[4-[(3-methyl-3-oxetanyl)methyl]phenyl]benzoic acid [4-[octan-2-yloxy(oxo)methyl]phenyl] ester IUPAC Name: (4-octan-2-yloxycarbonylphenyl) 4-[4-[(3-methyloxetan-3-yl)methyl]phenyl]benzoate Traditional Name: 4-[4-[(3-methyloxetan-3-yl)methyl]phenyl]benzoic acid [4-(1-methylheptoxycarbonyl)phenyl] ester Formula: C33H38O5 MolecularWeight: 514.65182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)CC4(COC4)C

Isomeric SMILES

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)CC4(COC4)C

InChI

InChI=1S/C33H38O5/c1-4-5-6-7-8-24(2)37-31(34)29-17-19-30(20-18-29)38-32(35)28-15-13-27(14-16-28)26-11-9-25(10-12-26)21-33(3)22-36-23-33/h9-20,24H,4-8,21-23H2,1-3H3