2-azanyl-6-ethanoyl-8,9-dihydro-7H-pyrimido[4,5-b][1,4]diazepin-4-olate

Systemtic Name: 2-azanyl-6-ethanoyl-8,9-dihydro-7H-pyrimido[4,5-b][1,4]diazepin-4-olate Openeye Name: 6-acetyl-2-amino-8,9-dihydro-7H-pyrimido[4,5-b][1,4]diazepin-4-olate CAS Name: 6-acetyl-2-amino-8,9-dihydro-7H-pyrimido[4,5-b][1,4]diazepin-4-olate IUPAC Name: 6-acetyl-2-amino-8,9-dihydro-7H-pyrimido[4,5-b][1,4]diazepin-4-olate Traditional Name: 6-acetyl-2-amino-8,9-dihydro-7H-pyrimido[4,5-b][1,4]diazepin-4-olate Formula: C9H10N5O2- MolecularWeight: 220.208

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NC2=C(NCC1)N=C(N=C2[O-])N

Isomeric SMILES

CC(=O)C1=NC2=C(NCC1)N=C(N=C2[O-])N

InChI

InChI=1S/C9H11N5O2/c1-4(15)5-2-3-11-7-6(12-5)8(16)14-9(10)13-7/h2-3H2,1H3,(H4,10,11,13,14,16)/p-1