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

Systemtic Name: (2-methyl-3-phenyl-propyl) 5-[[2,5-bis(oxidanyl)phenyl]methylamino]-2-oxidanyl-benzoate Openeye Name: (2-methyl-3-phenyl-propyl) 5-[(2,5-dihydroxyphenyl)methylamino]-2-hydroxy-benzoate CAS Name: 5-[(2,5-dihydroxyphenyl)methylamino]-2-hydroxybenzoic acid (2-methyl-3-phenylpropyl) ester IUPAC Name: (2-methyl-3-phenylpropyl) 5-[(2,5-dihydroxyphenyl)methylamino]-2-hydroxybenzoate Traditional Name: 5-[(2,5-dihydroxybenzyl)amino]-2-hydroxy-benzoic acid (2-methyl-3-phenyl-propyl) ester Formula: C24H25NO5 MolecularWeight: 407.459

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)COC(=O)C2=C(C=CC(=C2)NCC3=C(C=CC(=C3)O)O)O

Isomeric SMILES

CC(CC1=CC=CC=C1)COC(=O)C2=C(C=CC(=C2)NCC3=C(C=CC(=C3)O)O)O

InChI

InChI=1S/C24H25NO5/c1-16(11-17-5-3-2-4-6-17)15-30-24(29)21-13-19(7-9-23(21)28)25-14-18-12-20(26)8-10-22(18)27/h2-10,12-13,16,25-28H,11,14-15H2,1H3