4-chloranyl-1-(prop-2-enylamino)-N-[3-(trifluoromethyl)phenyl]phthalazine-6-carboxamide

Systemtic Name: 4-chloranyl-1-(prop-2-enylamino)-N-[3-(trifluoromethyl)phenyl]phthalazine-6-carboxamide Openeye Name: 1-(allylamino)-4-chloro-N-[3-(trifluoromethyl)phenyl]phthalazine-6-carboxamide CAS Name: 4-chloro-1-(prop-2-enylamino)-N-[3-(trifluoromethyl)phenyl]-6-phthalazinecarboxamide IUPAC Name: 4-chloro-1-(prop-2-enylamino)-N-[3-(trifluoromethyl)phenyl]phthalazine-6-carboxamide Traditional Name: 1-(allylamino)-4-chloro-N-[3-(trifluoromethyl)phenyl]phthalazine-6-carboxamide Formula: C19H14ClF3N4O MolecularWeight: 406.78887

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NN=C(C2=C1C=CC(=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F)Cl

Isomeric SMILES

C=CCNC1=NN=C(C2=C1C=CC(=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C19H14ClF3N4O/c1-2-8-24-17-14-7-6-11(9-15(14)16(20)26-27-17)18(28)25-13-5-3-4-12(10-13)19(21,22)23/h2-7,9-10H,1,8H2,(H,24,27)(H,25,28)