[4-[(4-oxidanylidenequinazolin-3-yl)methyl]phenyl]methylazanium

Systemtic Name: [4-[(4-oxidanylidenequinazolin-3-yl)methyl]phenyl]methylazanium Openeye Name: [4-[(4-oxoquinazolin-3-yl)methyl]phenyl]methylammonium CAS Name: [4-[(4-oxo-3-quinazolinyl)methyl]phenyl]methylammonium IUPAC Name: [4-[(4-oxoquinazolin-3-yl)methyl]phenyl]methylazanium Traditional Name: [4-[(4-ketoquinazolin-3-yl)methyl]benzyl]ammonium Formula: C16H16N3O+ MolecularWeight: 266.31774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C=N2)CC3=CC=C(C=C3)C[NH3+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C=N2)CC3=CC=C(C=C3)C[NH3+]

InChI

InChI=1S/C16H15N3O/c17-9-12-5-7-13(8-6-12)10-19-11-18-15-4-2-1-3-14(15)16(19)20/h1-8,11H,9-10,17H2/p+1