4-[[4-[methyl-(5-oxidanyl-5-oxidanylidene-pentyl)amino]phenyl]diazenyl]benzoic acid

Systemtic Name: 4-[[4-[methyl-(5-oxidanyl-5-oxidanylidene-pentyl)amino]phenyl]diazenyl]benzoic acid Openeye Name: 4-[4-[(5-hydroxy-5-oxo-pentyl)-methyl-amino]phenyl]azobenzoic acid CAS Name: 4-[4-[(5-hydroxy-5-oxopentyl)-methylamino]phenyl]azobenzoic acid IUPAC Name: 4-[[4-[(5-hydroxy-5-oxopentyl)-methylamino]phenyl]diazenyl]benzoic acid Traditional Name: 4-[4-[(5-hydroxy-5-keto-pentyl)-methyl-amino]phenyl]azobenzoic acid Formula: C19H21N3O4 MolecularWeight: 355.38774

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCC(=O)O)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CN(CCCCC(=O)O)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C19H21N3O4/c1-22(13-3-2-4-18(23)24)17-11-9-16(10-12-17)21-20-15-7-5-14(6-8-15)19(25)26/h5-12H,2-4,13H2,1H3,(H,23,24)(H,25,26)