(2S)-2-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]-3-oxidanyl-propanoate

Systemtic Name: (2S)-2-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]-3-oxidanyl-propanoate Openeye Name: (2S)-3-hydroxy-2-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]propanoate CAS Name: (2S)-3-hydroxy-2-[[(E)-3-(4-nitrophenyl)-1-oxoprop-2-enyl]amino]propanoate IUPAC Name: (2S)-3-hydroxy-2-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]propanoate Traditional Name: (2S)-3-hydroxy-2-[[(E)-3-(4-nitrophenyl)acryloyl]amino]propionate Formula: C12H11N2O6- MolecularWeight: 279.22554

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)NC(CO)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O6/c15-7-10(12(17)18)13-11(16)6-3-8-1-4-9(5-2-8)14(19)20/h1-6,10,15H,7H2,(H,13,16)(H,17,18)/p-1/b6-3+/t10-/m0/s1