2-[2,4-bis(bromanyl)phenyl]-4-[(3-methoxypropylamino)methylidene]-5-methyl-pyrazol-3-one

Systemtic Name: 2-[2,4-bis(bromanyl)phenyl]-4-[(3-methoxypropylamino)methylidene]-5-methyl-pyrazol-3-one Openeye Name: 2-(2,4-dibromophenyl)-4-[(3-methoxypropylamino)methylene]-5-methyl-pyrazol-3-one CAS Name: 2-(2,4-dibromophenyl)-4-[(3-methoxypropylamino)methylidene]-5-methyl-3-pyrazolone IUPAC Name: 2-(2,4-dibromophenyl)-4-[(3-methoxypropylamino)methylidene]-5-methylpyrazol-3-one Traditional Name: 2-(2,4-dibromophenyl)-4-[(3-methoxypropylamino)methylene]-5-methyl-2-pyrazolin-3-one Formula: C15H17Br2N3O2 MolecularWeight: 431.12238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CNCCCOC)C2=C(C=C(C=C2)Br)Br

Isomeric SMILES

CC1=NN(C(=O)C1=CNCCCOC)C2=C(C=C(C=C2)Br)Br

InChI

InChI=1S/C15H17Br2N3O2/c1-10-12(9-18-6-3-7-22-2)15(21)20(19-10)14-5-4-11(16)8-13(14)17/h4-5,8-9,18H,3,6-7H2,1-2H3