N-[4-[(4-bromanylphenoxy)methyl]phenyl]-6-oxidanylidene-1-propyl-pyridazine-3-carboxamide

Systemtic Name: N-[4-[(4-bromanylphenoxy)methyl]phenyl]-6-oxidanylidene-1-propyl-pyridazine-3-carboxamide Openeye Name: N-[4-[(4-bromophenoxy)methyl]phenyl]-6-oxo-1-propyl-pyridazine-3-carboxamide CAS Name: N-[4-[(4-bromophenoxy)methyl]phenyl]-6-oxo-1-propyl-3-pyridazinecarboxamide IUPAC Name: N-[4-[(4-bromophenoxy)methyl]phenyl]-6-oxo-1-propylpyridazine-3-carboxamide Traditional Name: N-[4-[(4-bromophenoxy)methyl]phenyl]-6-keto-1-propyl-pyridazine-3-carboxamide Formula: C21H20BrN3O3 MolecularWeight: 442.3058

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)C(=O)NC2=CC=C(C=C2)COC3=CC=C(C=C3)Br

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)C(=O)NC2=CC=C(C=C2)COC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H20BrN3O3/c1-2-13-25-20(26)12-11-19(24-25)21(27)23-17-7-3-15(4-8-17)14-28-18-9-5-16(22)6-10-18/h3-12H,2,13-14H2,1H3,(H,23,27)