2-[2-[carboxymethyl(phenylmethoxycarbonyl)amino]ethyl-phenylmethoxycarbonyl-amino]ethanoic acid

Systemtic Name: 2-[2-[carboxymethyl(phenylmethoxycarbonyl)amino]ethyl-phenylmethoxycarbonyl-amino]ethanoic acid Openeye Name: 2-[benzyloxycarbonyl-[2-[benzyloxycarbonyl(carboxymethyl)amino]ethyl]amino]acetic acid CAS Name: 2-[2-[carboxymethyl(phenylmethoxycarbonyl)amino]ethyl-phenylmethoxycarbonylamino]acetic acid IUPAC Name: 2-[2-[carboxymethyl(phenylmethoxycarbonyl)amino]ethyl-phenylmethoxycarbonylamino]acetic acid Traditional Name: 2-[carbobenzoxy-[2-[carbobenzoxy(carboxymethyl)amino]ethyl]amino]acetic acid Formula: C22H24N2O8 MolecularWeight: 444.43456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)N(CCN(CC(=O)O)C(=O)OCC2=CC=CC=C2)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N(CCN(CC(=O)O)C(=O)OCC2=CC=CC=C2)CC(=O)O

InChI

InChI=1S/C22H24N2O8/c25-19(26)13-23(21(29)31-15-17-7-3-1-4-8-17)11-12-24(14-20(27)28)22(30)32-16-18-9-5-2-6-10-18/h1-10H,11-16H2,(H,25,26)(H,27,28)