3-(2,4-dichlorophenyl)-6-fluoranyl-2-(1,2,4-triazol-1-yl)-4aH-quinazolin-3-ium-4-one

Systemtic Name: 3-(2,4-dichlorophenyl)-6-fluoranyl-2-(1,2,4-triazol-1-yl)-4aH-quinazolin-3-ium-4-one Openeye Name: 3-(2,4-dichlorophenyl)-6-fluoro-2-(1,2,4-triazol-1-yl)-4aH-quinazolin-3-ium-4-one CAS Name: 3-(2,4-dichlorophenyl)-6-fluoro-2-(1,2,4-triazol-1-yl)-4aH-quinazolin-3-ium-4-one IUPAC Name: 3-(2,4-dichlorophenyl)-6-fluoro-2-(1,2,4-triazol-1-yl)-4aH-quinazolin-3-ium-4-one Traditional Name: 3-(2,4-dichlorophenyl)-6-fluoro-2-(1,2,4-triazol-1-yl)-4aH-quinazolin-3-ium-4-one Formula: C16H9Cl2FN5O+ MolecularWeight: 377.179963

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC(=[N+](C(=O)C2C=C1F)C3=C(C=C(C=C3)Cl)Cl)N4C=NC=N4

Isomeric SMILES

C1=CC2=NC(=[N+](C(=O)C2C=C1F)C3=C(C=C(C=C3)Cl)Cl)N4C=NC=N4

InChI

InChI=1S/C16H9Cl2FN5O/c17-9-1-4-14(12(18)5-9)24-15(25)11-6-10(19)2-3-13(11)22-16(24)23-8-20-7-21-23/h1-8,11H/q+1