3-[3-(4-nitrophenoxy)-2-oxidanylidene-pyrrolidin-1-yl]benzoic acid

Systemtic Name: 3-[3-(4-nitrophenoxy)-2-oxidanylidene-pyrrolidin-1-yl]benzoic acid Openeye Name: 3-[3-(4-nitrophenoxy)-2-oxo-pyrrolidin-1-yl]benzoic acid CAS Name: 3-[3-(4-nitrophenoxy)-2-oxo-1-pyrrolidinyl]benzoic acid IUPAC Name: 3-[3-(4-nitrophenoxy)-2-oxopyrrolidin-1-yl]benzoic acid Traditional Name: 3-[2-keto-3-(4-nitrophenoxy)pyrrolidino]benzoic acid Formula: C17H14N2O6 MolecularWeight: 342.30286

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1OC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC(=C3)C(=O)O

Isomeric SMILES

C1CN(C(=O)C1OC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C17H14N2O6/c20-16-15(25-14-6-4-12(5-7-14)19(23)24)8-9-18(16)13-3-1-2-11(10-13)17(21)22/h1-7,10,15H,8-9H2,(H,21,22)