(4-dodecoxycarbonylphenyl) 3-chloranyl-4-oxidanyl-benzoate

Systemtic Name: (4-dodecoxycarbonylphenyl) 3-chloranyl-4-oxidanyl-benzoate Openeye Name: (4-dodecoxycarbonylphenyl) 3-chloro-4-hydroxy-benzoate CAS Name: 3-chloro-4-hydroxybenzoic acid [4-[dodecoxy(oxo)methyl]phenyl] ester IUPAC Name: (4-dodecoxycarbonylphenyl) 3-chloro-4-hydroxybenzoate Traditional Name: 3-chloro-4-hydroxy-benzoic acid (4-lauryloxycarbonylphenyl) ester Formula: C26H33ClO5 MolecularWeight: 460.99022

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)O)Cl

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)O)Cl

InChI

InChI=1S/C26H33ClO5/c1-2-3-4-5-6-7-8-9-10-11-18-31-25(29)20-12-15-22(16-13-20)32-26(30)21-14-17-24(28)23(27)19-21/h12-17,19,28H,2-11,18H2,1H3