6-azanyl-3-bromanyl-2-methyl-1H-pyridin-4-one hydrate

Systemtic Name: 6-azanyl-3-bromanyl-2-methyl-1H-pyridin-4-one hydrate Openeye Name: 6-amino-3-bromo-2-methyl-1H-pyridin-4-one hydrate CAS Name: 6-amino-3-bromo-2-methyl-1H-pyridin-4-one hydrate IUPAC Name: 6-amino-3-bromo-2-methyl-1H-pyridin-4-one hydrate Traditional Name: 6-amino-3-bromo-2-methyl-4-pyridone hydrate Formula: C6H9BrN2O2 MolecularWeight: 221.05186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C=C(N1)N)Br.O

Isomeric SMILES

CC1=C(C(=O)C=C(N1)N)Br.O

InChI

InChI=1S/C6H7BrN2O.H2O/c1-3-6(7)4(10)2-5(8)9-3;/h2H,1H3,(H3,8,9,10);1H2