6-iodanyl-2-propyl-3-[3-(trifluoromethyl)phenyl]-4aH-quinazolin-3-ium-4-one

Systemtic Name: 6-iodanyl-2-propyl-3-[3-(trifluoromethyl)phenyl]-4aH-quinazolin-3-ium-4-one Openeye Name: 6-iodo-2-propyl-3-[3-(trifluoromethyl)phenyl]-4aH-quinazolin-3-ium-4-one CAS Name: 6-iodo-2-propyl-3-[3-(trifluoromethyl)phenyl]-4aH-quinazolin-3-ium-4-one IUPAC Name: 6-iodo-2-propyl-3-[3-(trifluoromethyl)phenyl]-4aH-quinazolin-3-ium-4-one Traditional Name: 6-iodo-2-propyl-3-[3-(trifluoromethyl)phenyl]-4aH-quinazolin-3-ium-4-one Formula: C18H15F3IN2O+ MolecularWeight: 459.22418

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=[N+](C(=O)C2C=C(C=CC2=N1)I)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CCCC1=[N+](C(=O)C2C=C(C=CC2=N1)I)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C18H15F3IN2O/c1-2-4-16-23-15-8-7-12(22)10-14(15)17(25)24(16)13-6-3-5-11(9-13)18(19,20)21/h3,5-10,14H,2,4H2,1H3/q+1