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

Systemtic Name: 6-azanyl-3-[(4-hydroxyphenyl)methyl]-4aH-quinazolin-3-ium-4-one Openeye Name: 6-amino-3-[(4-hydroxyphenyl)methyl]-4aH-quinazolin-3-ium-4-one CAS Name: 6-amino-3-[(4-hydroxyphenyl)methyl]-4aH-quinazolin-3-ium-4-one IUPAC Name: 6-amino-3-[(4-hydroxyphenyl)methyl]-4aH-quinazolin-3-ium-4-one Traditional Name: 6-amino-3-(4-hydroxybenzyl)-4aH-quinazolin-3-ium-4-one Formula: C15H14N3O2+ MolecularWeight: 268.29056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C[N+]2=CN=C3C=CC(=CC3C2=O)N)O

Isomeric SMILES

C1=CC(=CC=C1C[N+]2=CN=C3C=CC(=CC3C2=O)N)O

InChI

InChI=1S/C15H13N3O2/c16-11-3-6-14-13(7-11)15(20)18(9-17-14)8-10-1-4-12(19)5-2-10/h1-7,9,13H,8,16H2/p+1