(2S)-2-[[(2S)-4-azanyl-4-oxidanylidene-2-(phenylmethoxycarbonylamino)butanoyl]amino]propanoic acid

Systemtic Name: (2S)-2-[[(2S)-4-azanyl-4-oxidanylidene-2-(phenylmethoxycarbonylamino)butanoyl]amino]propanoic acid Openeye Name: (2S)-2-[[(2S)-4-amino-2-(benzyloxycarbonylamino)-4-oxo-butanoyl]amino]propanoic acid CAS Name: (2S)-2-[[(2S)-4-amino-1,4-dioxo-2-(phenylmethoxycarbonylamino)butyl]amino]propanoic acid IUPAC Name: (2S)-2-[[(2S)-4-amino-4-oxo-2-(phenylmethoxycarbonylamino)butanoyl]amino]propanoic acid Traditional Name: (2S)-2-[[(2S)-4-amino-2-(benzyloxycarbonylamino)-4-keto-butanoyl]amino]propionic acid Formula: C15H19N3O6 MolecularWeight: 337.32786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N3O6/c1-9(14(21)22)17-13(20)11(7-12(16)19)18-15(23)24-8-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3,(H2,16,19)(H,17,20)(H,18,23)(H,21,22)/t9-,11-/m0/s1