2-chloranyl-6-ethyl-5-methyl-pyridine-3-carboxamide hydrate

Systemtic Name: 2-chloranyl-6-ethyl-5-methyl-pyridine-3-carboxamide hydrate Openeye Name: 2-chloro-6-ethyl-5-methyl-pyridine-3-carboxamide hydrate CAS Name: 2-chloro-6-ethyl-5-methyl-3-pyridinecarboxamide hydrate IUPAC Name: 2-chloro-6-ethyl-5-methylpyridine-3-carboxamide hydrate Traditional Name: 2-chloro-6-ethyl-5-methyl-nicotinamide hydrate Formula: C18H24Cl2N4O3 MolecularWeight: 415.31416

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=N1)Cl)C(=O)N)C.CCC1=C(C=C(C(=N1)Cl)C(=O)N)C.O

Isomeric SMILES

CCC1=C(C=C(C(=N1)Cl)C(=O)N)C.CCC1=C(C=C(C(=N1)Cl)C(=O)N)C.O

InChI

InChI=1S/2C9H11ClN2O.H2O/c2*1-3-7-5(2)4-6(9(11)13)8(10)12-7;/h2*4H,3H2,1-2H3,(H2,11,13);1H2