6-azanyl-3-(3-bromophenyl)-4aH-quinazolin-3-ium-4-one

Systemtic Name: 6-azanyl-3-(3-bromophenyl)-4aH-quinazolin-3-ium-4-one Openeye Name: 6-amino-3-(3-bromophenyl)-4aH-quinazolin-3-ium-4-one CAS Name: 6-amino-3-(3-bromophenyl)-4aH-quinazolin-3-ium-4-one IUPAC Name: 6-amino-3-(3-bromophenyl)-4aH-quinazolin-3-ium-4-one Traditional Name: 6-amino-3-(3-bromophenyl)-4aH-quinazolin-3-ium-4-one Formula: C14H11BrN3O+ MolecularWeight: 317.16064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)[N+]2=CN=C3C=CC(=CC3C2=O)N

Isomeric SMILES

C1=CC(=CC(=C1)Br)[N+]2=CN=C3C=CC(=CC3C2=O)N

InChI

InChI=1S/C14H11BrN3O/c15-9-2-1-3-11(6-9)18-8-17-13-5-4-10(16)7-12(13)14(18)19/h1-8,12H,16H2/q+1