5-azanyl-4-chloranyl-2-phenyl-1,2-diazinan-3-one hydrate

Systemtic Name: 5-azanyl-4-chloranyl-2-phenyl-1,2-diazinan-3-one hydrate Openeye Name: 5-amino-4-chloro-2-phenyl-hexahydropyridazin-3-one hydrate CAS Name: 5-amino-4-chloro-2-phenyl-3-diazinanone hydrate IUPAC Name: 5-amino-4-chloro-2-phenyldiazinan-3-one hydrate Traditional Name: 5-amino-4-chloro-2-phenyl-hexahydropyridazin-3-one hydrate Formula: C10H14ClN3O2 MolecularWeight: 243.69006

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(=O)N(N1)C2=CC=CC=C2)Cl)N.O

Isomeric SMILES

C1C(C(C(=O)N(N1)C2=CC=CC=C2)Cl)N.O

InChI

InChI=1S/C10H12ClN3O.H2O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7;/h1-5,8-9,13H,6,12H2;1H2