N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]-9H-xanthene-9-carboxamide

Systemtic Name: N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]-9H-xanthene-9-carboxamide Openeye Name: N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]-9H-xanthene-9-carboxamide CAS Name: N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]-9H-xanthene-9-carboxamide IUPAC Name: N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]-9H-xanthene-9-carboxamide Traditional Name: N-[3-[3-(trifluoromethyl)phenyl]prop-2-ynyl]-9H-xanthene-9-carboxamide Formula: C24H16F3NO2 MolecularWeight: 407.38455

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)NCC#CC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)NCC#CC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C24H16F3NO2/c25-24(26,27)17-9-5-7-16(15-17)8-6-14-28-23(29)22-18-10-1-3-12-20(18)30-21-13-4-2-11-19(21)22/h1-5,7,9-13,15,22H,14H2,(H,28,29)