3-[(E)-3-(4-nitrophenyl)prop-2-enoyl]-4-oxidanyl-benzoate

Systemtic Name: 3-[(E)-3-(4-nitrophenyl)prop-2-enoyl]-4-oxidanyl-benzoate Openeye Name: 4-hydroxy-3-[(E)-3-(4-nitrophenyl)prop-2-enoyl]benzoate CAS Name: 4-hydroxy-3-[(E)-3-(4-nitrophenyl)-1-oxoprop-2-enyl]benzoate IUPAC Name: 4-hydroxy-3-[(E)-3-(4-nitrophenyl)prop-2-enoyl]benzoate Traditional Name: 4-hydroxy-3-[(E)-3-(4-nitrophenyl)acryloyl]benzoate Formula: C16H10NO6- MolecularWeight: 312.2537

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)C2=C(C=CC(=C2)C(=O)[O-])O)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C16H11NO6/c18-14(13-9-11(16(20)21)4-8-15(13)19)7-3-10-1-5-12(6-2-10)17(22)23/h1-9,19H,(H,20,21)/p-1/b7-3+