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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOC(=O)C1=C(C=CC(=C1)NCC2=C(C=CC(=C2)O)O)O)C3=CC=CC=C3

Isomeric SMILES

CC(CCOC(=O)C1=C(C=CC(=C1)NCC2=C(C=CC(=C2)O)O)O)C3=CC=CC=C3

InChI

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