N-[2-(6-azanyl-4-oxidanylidene-4aH-quinazolin-3-ium-3-yl)ethyl]ethanamide

Systemtic Name: N-[2-(6-azanyl-4-oxidanylidene-4aH-quinazolin-3-ium-3-yl)ethyl]ethanamide Openeye Name: N-[2-(6-amino-4-oxo-4aH-quinazolin-3-ium-3-yl)ethyl]acetamide CAS Name: N-[2-(6-amino-4-oxo-4aH-quinazolin-3-ium-3-yl)ethyl]acetamide IUPAC Name: N-[2-(6-amino-4-oxo-4aH-quinazolin-3-ium-3-yl)ethyl]acetamide Traditional Name: N-[2-(6-amino-4-keto-4aH-quinazolin-3-ium-3-yl)ethyl]acetamide Formula: C12H15N4O2+ MolecularWeight: 247.2731

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC[N+]1=CN=C2C=CC(=CC2C1=O)N

Isomeric SMILES

CC(=O)NCC[N+]1=CN=C2C=CC(=CC2C1=O)N

InChI

InChI=1S/C12H14N4O2/c1-8(17)14-4-5-16-7-15-11-3-2-9(13)6-10(11)12(16)18/h2-3,6-7,10H,4-5,13H2,1H3/p+1