2-[[4-[(2-oxidanylidene-2-phenylmethoxy-ethyl)amino]phenyl]carbonylamino]pentanedioic acid

Systemtic Name: 2-[[4-[(2-oxidanylidene-2-phenylmethoxy-ethyl)amino]phenyl]carbonylamino]pentanedioic acid Openeye Name: 2-[[4-[(2-benzyloxy-2-oxo-ethyl)amino]benzoyl]amino]pentanedioic acid CAS Name: 2-[[oxo-[4-[(2-oxo-2-phenylmethoxyethyl)amino]phenyl]methyl]amino]pentanedioic acid IUPAC Name: 2-[[4-[(2-oxo-2-phenylmethoxyethyl)amino]benzoyl]amino]pentanedioic acid Traditional Name: 2-[[4-[(2-benzoxy-2-keto-ethyl)amino]benzoyl]amino]glutaric acid Formula: C21H22N2O7 MolecularWeight: 414.40858

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CNC2=CC=C(C=C2)C(=O)NC(CCC(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CNC2=CC=C(C=C2)C(=O)NC(CCC(=O)O)C(=O)O

InChI

InChI=1S/C21H22N2O7/c24-18(25)11-10-17(21(28)29)23-20(27)15-6-8-16(9-7-15)22-12-19(26)30-13-14-4-2-1-3-5-14/h1-9,17,22H,10-13H2,(H,23,27)(H,24,25)(H,28,29)