3,3-dimethylbutyl 5-[[2,5-bis(oxidanyl)phenyl]methylamino]-2-oxidanyl-benzoate

Systemtic Name: 3,3-dimethylbutyl 5-[[2,5-bis(oxidanyl)phenyl]methylamino]-2-oxidanyl-benzoate Openeye Name: 3,3-dimethylbutyl 5-[(2,5-dihydroxyphenyl)methylamino]-2-hydroxy-benzoate CAS Name: 5-[(2,5-dihydroxyphenyl)methylamino]-2-hydroxybenzoic acid 3,3-dimethylbutyl ester IUPAC Name: 3,3-dimethylbutyl 5-[(2,5-dihydroxyphenyl)methylamino]-2-hydroxybenzoate Traditional Name: 5-[(2,5-dihydroxybenzyl)amino]-2-hydroxy-benzoic acid 3,3-dimethylbutyl ester Formula: C20H25NO5 MolecularWeight: 359.4162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCOC(=O)C1=C(C=CC(=C1)NCC2=C(C=CC(=C2)O)O)O

Isomeric SMILES

CC(C)(C)CCOC(=O)C1=C(C=CC(=C1)NCC2=C(C=CC(=C2)O)O)O

InChI

InChI=1S/C20H25NO5/c1-20(2,3)8-9-26-19(25)16-11-14(4-6-18(16)24)21-12-13-10-15(22)5-7-17(13)23/h4-7,10-11,21-24H,8-9,12H2,1-3H3