methyl (2S)-2-[2-(phenylmethoxycarbonylamino)hexanoylamino]hexanoate

Systemtic Name: methyl (2S)-2-[2-(phenylmethoxycarbonylamino)hexanoylamino]hexanoate Openeye Name: methyl (2S)-2-[2-(benzyloxycarbonylamino)hexanoylamino]hexanoate CAS Name: (2S)-2-[[1-oxo-2-(phenylmethoxycarbonylamino)hexyl]amino]hexanoic acid methyl ester IUPAC Name: methyl (2S)-2-[2-(phenylmethoxycarbonylamino)hexanoylamino]hexanoate Traditional Name: (2S)-2-[2-(benzyloxycarbonylamino)hexanoylamino]hexanoic acid methyl ester Formula: C21H32N2O5 MolecularWeight: 392.48918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC(CCCC)C(=O)OC)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCCC[C@@H](C(=O)OC)NC(=O)C(CCCC)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C21H32N2O5/c1-4-6-13-17(19(24)22-18(14-7-5-2)20(25)27-3)23-21(26)28-15-16-11-9-8-10-12-16/h8-12,17-18H,4-7,13-15H2,1-3H3,(H,22,24)(H,23,26)/t17?,18-/m0/s1