[1-(7-chloranyl-2-propan-2-yl-quinazolin-4-yl)naphthalen-2-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [1-(7-chloranyl-2-propan-2-yl-quinazolin-4-yl)naphthalen-2-yl] tris(fluoranyl)methanesulfonate Openeye Name: [1-(7-chloro-2-isopropyl-quinazolin-4-yl)-2-naphthyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [1-(7-chloro-2-propan-2-yl-4-quinazolinyl)-2-naphthalenyl] ester IUPAC Name: [1-(7-chloro-2-propan-2-ylquinazolin-4-yl)naphthalen-2-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [1-(7-chloro-2-isopropyl-quinazolin-4-yl)-2-naphthyl] ester Formula: C22H16ClF3N2O3S MolecularWeight: 480.88725

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(C=CC(=C2)Cl)C(=N1)C3=C(C=CC4=CC=CC=C43)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC(C)C1=NC2=C(C=CC(=C2)Cl)C(=N1)C3=C(C=CC4=CC=CC=C43)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C22H16ClF3N2O3S/c1-12(2)21-27-17-11-14(23)8-9-16(17)20(28-21)19-15-6-4-3-5-13(15)7-10-18(19)31-32(29,30)22(24,25)26/h3-12H,1-2H3