(4-propan-2-ylphenyl)methyl 5-[[2,5-bis(oxidanyl)phenyl]methylamino]-2-oxidanyl-benzoate

Systemtic Name: (4-propan-2-ylphenyl)methyl 5-[[2,5-bis(oxidanyl)phenyl]methylamino]-2-oxidanyl-benzoate Openeye Name: (4-isopropylphenyl)methyl 5-[(2,5-dihydroxyphenyl)methylamino]-2-hydroxy-benzoate CAS Name: 5-[(2,5-dihydroxyphenyl)methylamino]-2-hydroxybenzoic acid (4-propan-2-ylphenyl)methyl ester IUPAC Name: (4-propan-2-ylphenyl)methyl 5-[(2,5-dihydroxyphenyl)methylamino]-2-hydroxybenzoate Traditional Name: 5-[(2,5-dihydroxybenzyl)amino]-2-hydroxy-benzoic acid (4-isopropylbenzyl) ester Formula: C24H25NO5 MolecularWeight: 407.459

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)COC(=O)C2=C(C=CC(=C2)NCC3=C(C=CC(=C3)O)O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)COC(=O)C2=C(C=CC(=C2)NCC3=C(C=CC(=C3)O)O)O

InChI

InChI=1S/C24H25NO5/c1-15(2)17-5-3-16(4-6-17)14-30-24(29)21-12-19(7-9-23(21)28)25-13-18-11-20(26)8-10-22(18)27/h3-12,15,25-28H,13-14H2,1-2H3