2-[[2-(4-nitrophenyl)-2-oxidanyl-ethyl]carbamoyl]benzoic acid

Systemtic Name: 2-[[2-(4-nitrophenyl)-2-oxidanyl-ethyl]carbamoyl]benzoic acid Openeye Name: 2-[[2-hydroxy-2-(4-nitrophenyl)ethyl]carbamoyl]benzoic acid CAS Name: 2-[[[2-hydroxy-2-(4-nitrophenyl)ethyl]amino]-oxomethyl]benzoic acid IUPAC Name: 2-[[2-hydroxy-2-(4-nitrophenyl)ethyl]carbamoyl]benzoic acid Traditional Name: 2-[[2-hydroxy-2-(4-nitrophenyl)ethyl]carbamoyl]benzoic acid Formula: C16H14N2O6 MolecularWeight: 330.29216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N2O6/c19-14(10-5-7-11(8-6-10)18(23)24)9-17-15(20)12-3-1-2-4-13(12)16(21)22/h1-8,14,19H,9H2,(H,17,20)(H,21,22)