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2,2-bis(phenoxycarbonylamino)hexanedioic acid

2,2-bis(phenoxycarbonylamino)hexanedioic acid

Systemtic Name:2,2-bis(phenoxycarbonylamino)hexanedioic acid
Openeye Name:2,2-bis(phenoxycarbonylamino)hexanedioic acid
CAS Name:2,2-bis[[oxo(phenoxy)methyl]amino]hexanedioic acid
IUPAC Name:2,2-bis(phenoxycarbonylamino)hexanedioic acid
Traditional Name:2,2-bis(carbophenoxyamino)adipic acid
Formula: C20H20N2O8
MolecularWeight: 416.3814
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)NC(CCCC(=O)O)(C(=O)O)NC(=O)OC2=CC=CC=C2


Isomeric SMILES

C1=CC=C(C=C1)OC(=O)NC(CCCC(=O)O)(C(=O)O)NC(=O)OC2=CC=CC=C2


InChI

InChI=1S/C20H20N2O8/c23-16(24)12-7-13-20(17(25)26,21-18(27)29-14-8-3-1-4-9-14)22-19(28)30-15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2,(H,21,27)(H,22,28)(H,23,24)(H,25,26)


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