4-(4-prop-2-ynoxyphenyl)-N-[3-(trifluoromethyl)phenyl]phthalazin-1-amine

Systemtic Name: 4-(4-prop-2-ynoxyphenyl)-N-[3-(trifluoromethyl)phenyl]phthalazin-1-amine Openeye Name: 4-(4-prop-2-ynoxyphenyl)-N-[3-(trifluoromethyl)phenyl]phthalazin-1-amine CAS Name: 4-(4-prop-2-ynoxyphenyl)-N-[3-(trifluoromethyl)phenyl]-1-phthalazinamine IUPAC Name: 4-(4-prop-2-ynoxyphenyl)-N-[3-(trifluoromethyl)phenyl]phthalazin-1-amine Traditional Name: [4-(4-propargyloxyphenyl)phthalazin-1-yl]-[3-(trifluoromethyl)phenyl]amine Formula: C24H16F3N3O MolecularWeight: 419.39855

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C#CCOC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C24H16F3N3O/c1-2-14-31-19-12-10-16(11-13-19)22-20-8-3-4-9-21(20)23(30-29-22)28-18-7-5-6-17(15-18)24(25,26)27/h1,3-13,15H,14H2,(H,28,30)