5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]-2-oxidanyl-benzoate

Systemtic Name: 5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]-2-oxidanyl-benzoate Openeye Name: 2-hydroxy-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]benzoate CAS Name: 2-hydroxy-5-[[(E)-3-(3-nitrophenyl)-1-oxoprop-2-enyl]amino]benzoate IUPAC Name: 2-hydroxy-5-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]benzoate Traditional Name: 2-hydroxy-5-[[(E)-3-(3-nitrophenyl)acryloyl]amino]benzoate Formula: C16H11N2O6- MolecularWeight: 327.26834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C=CC(=O)NC2=CC(=C(C=C2)O)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])/C=C/C(=O)NC2=CC(=C(C=C2)O)C(=O)[O-]

InChI

InChI=1S/C16H12N2O6/c19-14-6-5-11(9-13(14)16(21)22)17-15(20)7-4-10-2-1-3-12(8-10)18(23)24/h1-9,19H,(H,17,20)(H,21,22)/p-1/b7-4+