2-[(E)-1-(4-nitrophenyl)-3-oxidanyl-3-oxidanylidene-prop-1-en-2-yl]benzoic acid

Systemtic Name: 2-[(E)-1-(4-nitrophenyl)-3-oxidanyl-3-oxidanylidene-prop-1-en-2-yl]benzoic acid Openeye Name: 2-[(E)-1-carboxy-2-(4-nitrophenyl)vinyl]benzoic acid CAS Name: 2-[(E)-3-hydroxy-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzoic acid IUPAC Name: 2-[(E)-3-hydroxy-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzoic acid Traditional Name: 2-[(E)-1-carboxy-2-(4-nitrophenyl)vinyl]benzoic acid Formula: C16H11NO6 MolecularWeight: 313.26164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C16H11NO6/c18-15(19)13-4-2-1-3-12(13)14(16(20)21)9-10-5-7-11(8-6-10)17(22)23/h1-9H,(H,18,19)(H,20,21)/b14-9+