methyl 2-(4-hexadecoxyphenyl)-4,5-dimethyl-3,6-bis(oxidanyl)benzoate

Systemtic Name: methyl 2-(4-hexadecoxyphenyl)-4,5-dimethyl-3,6-bis(oxidanyl)benzoate Openeye Name: methyl 2-(4-hexadecoxyphenyl)-3,6-dihydroxy-4,5-dimethyl-benzoate CAS Name: 2-(4-hexadecoxyphenyl)-3,6-dihydroxy-4,5-dimethylbenzoic acid methyl ester IUPAC Name: methyl 2-(4-hexadecoxyphenyl)-3,6-dihydroxy-4,5-dimethylbenzoate Traditional Name: 2-(4-cetyloxyphenyl)-3,6-dihydroxy-4,5-dimethyl-benzoic acid methyl ester Formula: C32H48O5 MolecularWeight: 512.72052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C2=C(C(=C(C(=C2O)C)C)O)C(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC=C(C=C1)C2=C(C(=C(C(=C2O)C)C)O)C(=O)OC

InChI

InChI=1S/C32H48O5/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-37-27-21-19-26(20-22-27)28-29(32(35)36-4)31(34)25(3)24(2)30(28)33/h19-22,33-34H,5-18,23H2,1-4H3