2-[[(2-chlorophenyl)amino]-pyridin-2-yl-methyl]-6-(hydroxymethyl)-3-oxidanyl-pyran-4-one

Systemtic Name: 2-[[(2-chlorophenyl)amino]-pyridin-2-yl-methyl]-6-(hydroxymethyl)-3-oxidanyl-pyran-4-one Openeye Name: 2-[(2-chloroanilino)-(2-pyridyl)methyl]-3-hydroxy-6-(hydroxymethyl)pyran-4-one CAS Name: 2-[(2-chloroanilino)-(2-pyridinyl)methyl]-3-hydroxy-6-(hydroxymethyl)-4-pyranone IUPAC Name: 2-[(2-chloroanilino)-pyridin-2-ylmethyl]-3-hydroxy-6-(hydroxymethyl)pyran-4-one Traditional Name: 2-[(2-chloroanilino)-(2-pyridyl)methyl]-3-hydroxy-6-methylol-pyran-4-one Formula: C18H15ClN2O4 MolecularWeight: 358.7757

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(C2=CC=CC=N2)C3=C(C(=O)C=C(O3)CO)O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)NC(C2=CC=CC=N2)C3=C(C(=O)C=C(O3)CO)O)Cl

InChI

InChI=1S/C18H15ClN2O4/c19-12-5-1-2-6-13(12)21-16(14-7-3-4-8-20-14)18-17(24)15(23)9-11(10-22)25-18/h1-9,16,21-22,24H,10H2