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

Systemtic Name: 6-azanyl-3-(4-hydroxyphenyl)-4aH-quinazolin-3-ium-4-one Openeye Name: 6-amino-3-(4-hydroxyphenyl)-4aH-quinazolin-3-ium-4-one CAS Name: 6-amino-3-(4-hydroxyphenyl)-4aH-quinazolin-3-ium-4-one IUPAC Name: 6-amino-3-(4-hydroxyphenyl)-4aH-quinazolin-3-ium-4-one Traditional Name: 6-amino-3-(4-hydroxyphenyl)-4aH-quinazolin-3-ium-4-one Formula: C14H12N3O2+ MolecularWeight: 254.26398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11N3O2/c15-9-1-6-13-12(7-9)14(19)17(8-16-13)10-2-4-11(18)5-3-10/h1-8,12H,15H2/p+1