2-azanyl-2-[bis(phenylmethoxycarbonyl)amino]heptanedioic acid

Systemtic Name: 2-azanyl-2-[bis(phenylmethoxycarbonyl)amino]heptanedioic acid Openeye Name: 2-amino-2-[bis(benzyloxycarbonyl)amino]heptanedioic acid CAS Name: 2-amino-2-[bis(phenylmethoxycarbonyl)amino]heptanedioic acid IUPAC Name: 2-amino-2-[bis(phenylmethoxycarbonyl)amino]heptanedioic acid Traditional Name: 2-amino-2-(dicarbobenzoxyamino)pimelic acid Formula: C23H26N2O8 MolecularWeight: 458.46114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N2O8/c24-23(20(28)29,14-8-7-13-19(26)27)25(21(30)32-15-17-9-3-1-4-10-17)22(31)33-16-18-11-5-2-6-12-18/h1-6,9-12H,7-8,13-16,24H2,(H,26,27)(H,28,29)