(2S)-2-[[(2S)-2-azanyl-3-phenyl-propanoyl]-oxidanyl-amino]-4-oxidanylidene-but-3-enoic acid

Systemtic Name: (2S)-2-[[(2S)-2-azanyl-3-phenyl-propanoyl]-oxidanyl-amino]-4-oxidanylidene-but-3-enoic acid Openeye Name: (2S)-2-[[(2S)-2-amino-3-phenyl-propanoyl]-hydroxy-amino]-4-oxo-but-3-enoic acid CAS Name: (2S)-2-[[(2S)-2-amino-1-oxo-3-phenylpropyl]-hydroxyamino]-4-oxo-3-butenoic acid IUPAC Name: (2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]-hydroxyamino]-4-oxobut-3-enoic acid Traditional Name: (2S)-2-[[(2S)-2-amino-3-phenyl-propanoyl]-hydroxy-amino]-4-keto-but-3-enoic acid Formula: C13H14N2O5 MolecularWeight: 278.26066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O5/c14-10(8-9-4-2-1-3-5-9)12(17)15(20)11(6-7-16)13(18)19/h1-6,10-11,20H,8,14H2,(H,18,19)/t10-,11-/m0/s1