methyl 4-chloranyl-6-phenyl-pyridine-2-carboxylate; (phenylmethyl) carbamate

Systemtic Name: methyl 4-chloranyl-6-phenyl-pyridine-2-carboxylate; (phenylmethyl) carbamate Openeye Name: benzyl carbamate; methyl 4-chloro-6-phenyl-pyridine-2-carboxylate CAS Name: carbamic acid (phenylmethyl) ester; 4-chloro-6-phenyl-2-pyridinecarboxylic acid methyl ester IUPAC Name: benzyl carbamate; methyl 4-chloro-6-phenylpyridine-2-carboxylate Traditional Name: carbamic acid benzyl ester; 4-chloro-6-phenyl-picolinic acid methyl ester Formula: C21H19ClN2O4 MolecularWeight: 398.83956

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=N1)C2=CC=CC=C2)Cl.C1=CC=C(C=C1)COC(=O)N

Isomeric SMILES

COC(=O)C1=CC(=CC(=N1)C2=CC=CC=C2)Cl.C1=CC=C(C=C1)COC(=O)N

InChI

InChI=1S/C13H10ClNO2.C8H9NO2/c1-17-13(16)12-8-10(14)7-11(15-12)9-5-3-2-4-6-9;9-8(10)11-6-7-4-2-1-3-5-7/h2-8H,1H3;1-5H,6H2,(H2,9,10)