6-(4-methylphenyl)pyridine-2-carboxylic acid; (phenylmethyl) carbamate

Systemtic Name: 6-(4-methylphenyl)pyridine-2-carboxylic acid; (phenylmethyl) carbamate Openeye Name: benzyl carbamate; 6-(p-tolyl)pyridine-2-carboxylic acid CAS Name: carbamic acid (phenylmethyl) ester; 6-(4-methylphenyl)-2-pyridinecarboxylic acid IUPAC Name: benzyl carbamate; 6-(4-methylphenyl)pyridine-2-carboxylic acid Traditional Name: carbamic acid benzyl ester; 6-(p-tolyl)picolinic acid Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CC=C2)C(=O)O.C1=CC=C(C=C1)COC(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CC=C2)C(=O)O.C1=CC=C(C=C1)COC(=O)N

InChI

InChI=1S/C13H11NO2.C8H9NO2/c1-9-5-7-10(8-6-9)11-3-2-4-12(14-11)13(15)16;9-8(10)11-6-7-4-2-1-3-5-7/h2-8H,1H3,(H,15,16);1-5H,6H2,(H2,9,10)