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

Systemtic Name: 6-azanyl-3-[(4-methoxyphenyl)methyl]-4aH-quinazolin-3-ium-4-one Openeye Name: 6-amino-3-[(4-methoxyphenyl)methyl]-4aH-quinazolin-3-ium-4-one CAS Name: 6-amino-3-[(4-methoxyphenyl)methyl]-4aH-quinazolin-3-ium-4-one IUPAC Name: 6-amino-3-[(4-methoxyphenyl)methyl]-4aH-quinazolin-3-ium-4-one Traditional Name: 6-amino-3-p-anisyl-4aH-quinazolin-3-ium-4-one Formula: C16H16N3O2+ MolecularWeight: 282.31714

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[N+]2=CN=C3C=CC(=CC3C2=O)N

Isomeric SMILES

COC1=CC=C(C=C1)C[N+]2=CN=C3C=CC(=CC3C2=O)N

InChI

InChI=1S/C16H16N3O2/c1-21-13-5-2-11(3-6-13)9-19-10-18-15-7-4-12(17)8-14(15)16(19)20/h2-8,10,14H,9,17H2,1H3/q+1