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

Systemtic Name: 3-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]propanoate Openeye Name: 3-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]propanoate CAS Name: 3-[[(E)-3-(4-nitrophenyl)-1-oxoprop-2-enyl]amino]propanoate IUPAC Name: 3-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]propanoate Traditional Name: 3-[[(E)-3-(4-nitrophenyl)acryloyl]amino]propionate Formula: C12H11N2O5- MolecularWeight: 263.22614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)NCCC(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1/C=C/C(=O)NCCC(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H12N2O5/c15-11(13-8-7-12(16)17)6-3-9-1-4-10(5-2-9)14(18)19/h1-6H,7-8H2,(H,13,15)(H,16,17)/p-1/b6-3+