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

Systemtic Name: methyl (2S)-2-[2-(phenylmethoxycarbonylamino)pentanoylamino]hexanoate Openeye Name: methyl (2S)-2-[2-(benzyloxycarbonylamino)pentanoylamino]hexanoate CAS Name: (2S)-2-[[1-oxo-2-(phenylmethoxycarbonylamino)pentyl]amino]hexanoic acid methyl ester IUPAC Name: methyl (2S)-2-[2-(phenylmethoxycarbonylamino)pentanoylamino]hexanoate Traditional Name: (2S)-2-[2-(benzyloxycarbonylamino)pentanoylamino]hexanoic acid methyl ester Formula: C20H30N2O5 MolecularWeight: 378.4626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30N2O5/c1-4-6-13-17(19(24)26-3)21-18(23)16(10-5-2)22-20(25)27-14-15-11-8-7-9-12-15/h7-9,11-12,16-17H,4-6,10,13-14H2,1-3H3,(H,21,23)(H,22,25)/t16?,17-/m0/s1