methyl (2S)-2-[[3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]propanoate

Systemtic Name: methyl (2S)-2-[[3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]propanoate Openeye Name: methyl (2S)-2-[[2-(benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]propanoate CAS Name: (2S)-2-[[3-methyl-1-oxo-2-(phenylmethoxycarbonylamino)pentyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]propanoate Traditional Name: (2S)-2-[[2-(benzyloxycarbonylamino)-3-methyl-pentanoyl]amino]propionic acid methyl ester Formula: C18H26N2O5 MolecularWeight: 350.40944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N2O5/c1-5-12(2)15(16(21)19-13(3)17(22)24-4)20-18(23)25-11-14-9-7-6-8-10-14/h6-10,12-13,15H,5,11H2,1-4H3,(H,19,21)(H,20,23)/t12?,13-,15?/m0/s1