N-[2,6-bis(chloranyl)-4-oxaldehydoyl-phenyl]-2,2-dimethyl-propanamide hydrate

Systemtic Name: N-[2,6-bis(chloranyl)-4-oxaldehydoyl-phenyl]-2,2-dimethyl-propanamide hydrate Openeye Name: N-(2,6-dichloro-4-oxaldehydoyl-phenyl)-2,2-dimethyl-propanamide hydrate CAS Name: N-(2,6-dichloro-4-oxaldehydoylphenyl)-2,2-dimethylpropanamide hydrate IUPAC Name: N-(2,6-dichloro-4-oxaldehydoylphenyl)-2,2-dimethylpropanamide hydrate Traditional Name: N-(2,6-dichloro-4-glyoxyloyl-phenyl)-2,2-dimethyl-propionamide hydrate Formula: C13H15Cl2NO4 MolecularWeight: 320.1685

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=C(C=C(C=C1Cl)C(=O)C=O)Cl.O

Isomeric SMILES

CC(C)(C)C(=O)NC1=C(C=C(C=C1Cl)C(=O)C=O)Cl.O

InChI

InChI=1S/C13H13Cl2NO3.H2O/c1-13(2,3)12(19)16-11-8(14)4-7(5-9(11)15)10(18)6-17;/h4-6H,1-3H3,(H,16,19);1H2