[(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] (3R)-3-acetamido-3-phenyl-propanoate

Systemtic Name: [(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] (3R)-3-acetamido-3-phenyl-propanoate Openeye Name: [(1R)-1-allophanoyl-2-methyl-propyl] (3R)-3-acetamido-3-phenyl-propanoate CAS Name: (3R)-3-acetamido-3-phenylpropanoic acid [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] (3R)-3-acetamido-3-phenylpropanoate Traditional Name: (3R)-3-acetamido-3-phenyl-propionic acid [(1R)-1-allophanoyl-2-methyl-propyl] ester Formula: C17H23N3O5 MolecularWeight: 349.38162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)OC(=O)CC(C1=CC=CC=C1)NC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C17H23N3O5/c1-10(2)15(16(23)20-17(18)24)25-14(22)9-13(19-11(3)21)12-7-5-4-6-8-12/h4-8,10,13,15H,9H2,1-3H3,(H,19,21)(H3,18,20,23,24)/t13-,15-/m1/s1