(2S)-4-azanyl-4-oxidanylidene-2-[[(E)-3-phenylprop-2-enoyl]amino]butanoate

Systemtic Name: (2S)-4-azanyl-4-oxidanylidene-2-[[(E)-3-phenylprop-2-enoyl]amino]butanoate Openeye Name: (2S)-4-amino-4-oxo-2-[[(E)-3-phenylprop-2-enoyl]amino]butanoate CAS Name: (2S)-4-amino-4-oxo-2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]butanoate IUPAC Name: (2S)-4-amino-4-oxo-2-[[(E)-3-phenylprop-2-enoyl]amino]butanoate Traditional Name: (2S)-4-amino-4-keto-2-[[(E)-3-phenylacryloyl]amino]butyrate Formula: C13H13N2O4- MolecularWeight: 261.25332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)NC(CC(=O)N)C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O4/c14-11(16)8-10(13(18)19)15-12(17)7-6-9-4-2-1-3-5-9/h1-7,10H,8H2,(H2,14,16)(H,15,17)(H,18,19)/p-1/b7-6+/t10-/m0/s1