N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide

Systemtic Name: N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide Openeye Name: N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]chromane-3-carboxamide CAS Name: N-[2-(1-pyrazolyl)-5-(trifluoromethyl)phenyl]-3,4-dihydro-2H-1-benzopyran-3-carboxamide IUPAC Name: N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]-3,4-dihydro-2H-chromene-3-carboxamide Traditional Name: N-[2-pyrazol-1-yl-5-(trifluoromethyl)phenyl]chroman-3-carboxamide Formula: C20H16F3N3O2 MolecularWeight: 387.35515

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Descriptors Computed from Structure

Canonical SMILES:

C1C(COC2=CC=CC=C21)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4C=CC=N4

Isomeric SMILES

C1C(COC2=CC=CC=C21)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4C=CC=N4

InChI

InChI=1S/C20H16F3N3O2/c21-20(22,23)15-6-7-17(26-9-3-8-24-26)16(11-15)25-19(27)14-10-13-4-1-2-5-18(13)28-12-14/h1-9,11,14H,10,12H2,(H,25,27)