methyl (2S)-3-methyl-2-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]pentanoate

Systemtic Name: methyl (2S)-3-methyl-2-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]pentanoate Openeye Name: methyl (2S)-2-[[(2S)-2-(benzyloxycarbonylamino)propanoyl]amino]-3-methyl-pentanoate CAS Name: (2S)-3-methyl-2-[[(2S)-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]pentanoic acid methyl ester IUPAC Name: methyl (2S)-3-methyl-2-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]pentanoate Traditional Name: (2S)-2-[[(2S)-2-(benzyloxycarbonylamino)propanoyl]amino]-3-methyl-valeric acid methyl ester Formula: C18H26N2O5 MolecularWeight: 350.40944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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