(4-octan-2-yloxycarbonylphenyl) 4-[4-[2-(methoxymethyl)-2-methyl-butyl]phenyl]benzoate

Systemtic Name: (4-octan-2-yloxycarbonylphenyl) 4-[4-[2-(methoxymethyl)-2-methyl-butyl]phenyl]benzoate Openeye Name: [4-(1-methylheptoxycarbonyl)phenyl] 4-[4-[2-(methoxymethyl)-2-methyl-butyl]phenyl]benzoate CAS Name: 4-[4-[2-(methoxymethyl)-2-methylbutyl]phenyl]benzoic acid [4-[octan-2-yloxy(oxo)methyl]phenyl] ester IUPAC Name: (4-octan-2-yloxycarbonylphenyl) 4-[4-[2-(methoxymethyl)-2-methylbutyl]phenyl]benzoate Traditional Name: 4-[4-[2-(methoxymethyl)-2-methyl-butyl]phenyl]benzoic acid [4-(1-methylheptoxycarbonyl)phenyl] ester Formula: C35H44O5 MolecularWeight: 544.72086

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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)CC(C)(CC)COC

Isomeric SMILES

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)CC(C)(CC)COC

InChI

InChI=1S/C35H44O5/c1-6-8-9-10-11-26(3)39-33(36)31-20-22-32(23-21-31)40-34(37)30-18-16-29(17-19-30)28-14-12-27(13-15-28)24-35(4,7-2)25-38-5/h12-23,26H,6-11,24-25H2,1-5H3