(4-tert-butylphenyl)methyl 5-chloranyl-2-oxidanyl-benzoate

Systemtic Name: (4-tert-butylphenyl)methyl 5-chloranyl-2-oxidanyl-benzoate Openeye Name: (4-tert-butylphenyl)methyl 5-chloro-2-hydroxy-benzoate CAS Name: 5-chloro-2-hydroxybenzoic acid (4-tert-butylphenyl)methyl ester IUPAC Name: (4-tert-butylphenyl)methyl 5-chloro-2-hydroxybenzoate Traditional Name: 5-chloro-2-hydroxy-benzoic acid (4-tert-butylbenzyl) ester Formula: C18H19ClO3 MolecularWeight: 318.79466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COC(=O)C2=C(C=CC(=C2)Cl)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)COC(=O)C2=C(C=CC(=C2)Cl)O

InChI

InChI=1S/C18H19ClO3/c1-18(2,3)13-6-4-12(5-7-13)11-22-17(21)15-10-14(19)8-9-16(15)20/h4-10,20H,11H2,1-3H3