N-cyclopropyl-4-methyl-3-[1-[3,3,3-tris(fluoranyl)prop-1-en-2-yl]phthalazin-6-yl]benzamide

Systemtic Name: N-cyclopropyl-4-methyl-3-[1-[3,3,3-tris(fluoranyl)prop-1-en-2-yl]phthalazin-6-yl]benzamide Openeye Name: N-cyclopropyl-4-methyl-3-[1-[1-(trifluoromethyl)vinyl]phthalazin-6-yl]benzamide CAS Name: N-cyclopropyl-4-methyl-3-[1-(3,3,3-trifluoroprop-1-en-2-yl)-6-phthalazinyl]benzamide IUPAC Name: N-cyclopropyl-4-methyl-3-[1-(3,3,3-trifluoroprop-1-en-2-yl)phthalazin-6-yl]benzamide Traditional Name: N-cyclopropyl-4-methyl-3-[1-[1-(trifluoromethyl)vinyl]phthalazin-6-yl]benzamide Formula: C22H18F3N3O MolecularWeight: 397.39303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC2)C3=CC4=CN=NC(=C4C=C3)C(=C)C(F)(F)F

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)C3=CC4=CN=NC(=C4C=C3)C(=C)C(F)(F)F

InChI

InChI=1S/C22H18F3N3O/c1-12-3-4-15(21(29)27-17-6-7-17)10-19(12)14-5-8-18-16(9-14)11-26-28-20(18)13(2)22(23,24)25/h3-5,8-11,17H,2,6-7H2,1H3,(H,27,29)