3-nitrobenzoic acid; 2-pyridin-2-ylethanol

Systemtic Name: 3-nitrobenzoic acid; 2-pyridin-2-ylethanol Openeye Name: 3-nitrobenzoic acid; 2-(2-pyridyl)ethanol CAS Name: 3-nitrobenzoic acid; 2-(2-pyridinyl)ethanol IUPAC Name: 3-nitrobenzoic acid; 2-pyridin-2-ylethanol Traditional Name: 3-nitrobenzoic acid; 2-(2-pyridyl)ethanol Formula: C14H14N2O5 MolecularWeight: 290.27136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CCO.C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=NC(=C1)CCO.C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C7H5NO4.C7H9NO/c9-7(10)5-2-1-3-6(4-5)8(11)12;9-6-4-7-3-1-2-5-8-7/h1-4H,(H,9,10);1-3,5,9H,4,6H2