ethyl (2S)-2-[[(E)-2-benzamido-2-nitro-ethenyl]amino]propanoate

Systemtic Name: ethyl (2S)-2-[[(E)-2-benzamido-2-nitro-ethenyl]amino]propanoate Openeye Name: ethyl (2S)-2-[[(E)-2-benzamido-2-nitro-vinyl]amino]propanoate CAS Name: (2S)-2-[[(E)-2-benzamido-2-nitroethenyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[[(E)-2-benzamido-2-nitroethenyl]amino]propanoate Traditional Name: (2S)-2-[[(E)-2-benzamido-2-nitro-vinyl]amino]propionic acid ethyl ester Formula: C14H17N3O5 MolecularWeight: 307.30188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)[C@H](C)N/C=C(\NC(=O)C1=CC=CC=C1)/[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O5/c1-3-22-14(19)10(2)15-9-12(17(20)21)16-13(18)11-7-5-4-6-8-11/h4-10,15H,3H2,1-2H3,(H,16,18)/b12-9+/t10-/m0/s1