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6-(6-azanylhexanoylamino)-2-(phenylmethoxycarbonylamino)hexanoic acid

6-(6-azanylhexanoylamino)-2-(phenylmethoxycarbonylamino)hexanoic acid

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

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CCCCNC(=O)CCCCCN)C(=O)O


Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CCCCNC(=O)CCCCCN)C(=O)O


InChI

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


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