3-oxidanylchromen-2-one; N-[4-(trifluoromethyl)phenyl]methanamide

Systemtic Name: 3-oxidanylchromen-2-one; N-[4-(trifluoromethyl)phenyl]methanamide Openeye Name: 3-hydroxychromen-2-one; N-[4-(trifluoromethyl)phenyl]formamide CAS Name: 3-hydroxy-1-benzopyran-2-one; N-[4-(trifluoromethyl)phenyl]formamide IUPAC Name: 3-hydroxychromen-2-one; N-[4-(trifluoromethyl)phenyl]formamide Traditional Name: 3-hydroxycoumarin; N-[4-(trifluoromethyl)phenyl]formamide Formula: C17H12F3NO4 MolecularWeight: 351.27669

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)O2)O.C1=CC(=CC=C1C(F)(F)F)NC=O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)O2)O.C1=CC(=CC=C1C(F)(F)F)NC=O

InChI

InChI=1S/C9H6O3.C8H6F3NO/c10-7-5-6-3-1-2-4-8(6)12-9(7)11;9-8(10,11)6-1-3-7(4-2-6)12-5-13/h1-5,10H;1-5H,(H,12,13)