4-[2-carboxy-5-oxidanylidene-5-(phenylmethoxyamino)pentyl]benzoic acid

Systemtic Name: 4-[2-carboxy-5-oxidanylidene-5-(phenylmethoxyamino)pentyl]benzoic acid Openeye Name: 4-[5-(benzyloxyamino)-2-carboxy-5-oxo-pentyl]benzoic acid CAS Name: 4-[2-carboxy-5-oxo-5-(phenylmethoxyamino)pentyl]benzoic acid IUPAC Name: 4-[2-carboxy-5-oxo-5-(phenylmethoxyamino)pentyl]benzoic acid Traditional Name: 4-[5-(benzoxyamino)-2-carboxy-5-keto-pentyl]benzoic acid Formula: C20H21NO6 MolecularWeight: 371.38384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CONC(=O)CCC(CC2=CC=C(C=C2)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CONC(=O)CCC(CC2=CC=C(C=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C20H21NO6/c22-18(21-27-13-15-4-2-1-3-5-15)11-10-17(20(25)26)12-14-6-8-16(9-7-14)19(23)24/h1-9,17H,10-13H2,(H,21,22)(H,23,24)(H,25,26)