1-(2,6-dimethylphenyl)-4-(methoxyamino)-1,3,5-triazin-2-one hydrate

Systemtic Name: 1-(2,6-dimethylphenyl)-4-(methoxyamino)-1,3,5-triazin-2-one hydrate Openeye Name: 1-(2,6-dimethylphenyl)-4-(methoxyamino)-1,3,5-triazin-2-one hydrate CAS Name: 1-(2,6-dimethylphenyl)-4-(methoxyamino)-1,3,5-triazin-2-one hydrate IUPAC Name: 1-(2,6-dimethylphenyl)-4-(methoxyamino)-1,3,5-triazin-2-one hydrate Traditional Name: 1-(2,6-dimethylphenyl)-4-(methoxyamino)-s-triazin-2-one hydrate Formula: C12H16N4O3 MolecularWeight: 264.28044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C=NC(=NC2=O)NOC.O

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C=NC(=NC2=O)NOC.O

InChI

InChI=1S/C12H14N4O2.H2O/c1-8-5-4-6-9(2)10(8)16-7-13-11(15-18-3)14-12(16)17;/h4-7H,1-3H3,(H,14,15,17);1H2