(2S)-3-(2-methylpropanoylamino)-2-(phenylmethoxycarbonylamino)propanoic acid

Systemtic Name: (2S)-3-(2-methylpropanoylamino)-2-(phenylmethoxycarbonylamino)propanoic acid Openeye Name: (2S)-2-(benzyloxycarbonylamino)-3-(2-methylpropanoylamino)propanoic acid CAS Name: (2S)-3-[(2-methyl-1-oxopropyl)amino]-2-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: (2S)-3-(2-methylpropanoylamino)-2-(phenylmethoxycarbonylamino)propanoic acid Traditional Name: (2S)-2-(benzyloxycarbonylamino)-3-(isobutyrylamino)propionic acid Formula: C15H20N2O5 MolecularWeight: 308.3297

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCC(C(=O)O)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O5/c1-10(2)13(18)16-8-12(14(19)20)17-15(21)22-9-11-6-4-3-5-7-11/h3-7,10,12H,8-9H2,1-2H3,(H,16,18)(H,17,21)(H,19,20)/t12-/m0/s1