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6-azanyl-2-[6-(phenylmethoxycarbonylamino)hexanoylamino]hexanoic acid

6-azanyl-2-[6-(phenylmethoxycarbonylamino)hexanoylamino]hexanoic acid

Systemtic Name:6-azanyl-2-[6-(phenylmethoxycarbonylamino)hexanoylamino]hexanoic acid
Openeye Name:6-amino-2-[6-(benzyloxycarbonylamino)hexanoylamino]hexanoic acid
CAS Name:6-amino-2-[[1-oxo-6-(phenylmethoxycarbonylamino)hexyl]amino]hexanoic acid
IUPAC Name:6-amino-2-[6-(phenylmethoxycarbonylamino)hexanoylamino]hexanoic acid
Traditional Name:6-amino-2-[6-(benzyloxycarbonylamino)hexanoylamino]hexanoic acid
Formula: C20H31N3O5
MolecularWeight: 393.47724
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCCCCCC(=O)NC(CCCCN)C(=O)O


Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCCCCCC(=O)NC(CCCCN)C(=O)O


InChI

InChI=1S/C20H31N3O5/c21-13-7-6-11-17(19(25)26)23-18(24)12-5-2-8-14-22-20(27)28-15-16-9-3-1-4-10-16/h1,3-4,9-10,17H,2,5-8,11-15,21H2,(H,22,27)(H,23,24)(H,25,26)


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