2-methylpropyl hydrogen carbonate; 4-pyridin-2-ylbenzoic acid

Systemtic Name: 2-methylpropyl hydrogen carbonate; 4-pyridin-2-ylbenzoic acid Openeye Name: isobutyl hydrogen carbonate; 4-(2-pyridyl)benzoic acid CAS Name: carbonic acid 2-methylpropyl ester; 4-(2-pyridinyl)benzoic acid IUPAC Name: 2-methylpropyl hydrogen carbonate; 4-pyridin-2-ylbenzoic acid Traditional Name: carbonic acid isobutyl ester; 4-(2-pyridyl)benzoic acid Formula: C17H19NO5 MolecularWeight: 317.33646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)O.C1=CC=NC(=C1)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC(C)COC(=O)O.C1=CC=NC(=C1)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C12H9NO2.C5H10O3/c14-12(15)10-6-4-9(5-7-10)11-3-1-2-8-13-11;1-4(2)3-8-5(6)7/h1-8H,(H,14,15);4H,3H2,1-2H3,(H,6,7)