3-[4-(butylamino)-3-nitro-phenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one

Systemtic Name: 3-[4-(butylamino)-3-nitro-phenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one Openeye Name: 3-[4-(butylamino)-3-nitro-phenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one CAS Name: 3-[4-(butylamino)-3-nitrophenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one IUPAC Name: 3-[4-(butylamino)-3-nitrophenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one Traditional Name: 3-[4-(butylamino)-3-nitro-phenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one Formula: C15H20N4O3 MolecularWeight: 304.3443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=C(C=C1)C2=NNC(=O)CC2C)[N+](=O)[O-]

Isomeric SMILES

CCCCNC1=C(C=C(C=C1)C2=NNC(=O)CC2C)[N+](=O)[O-]

InChI

InChI=1S/C15H20N4O3/c1-3-4-7-16-12-6-5-11(9-13(12)19(21)22)15-10(2)8-14(20)17-18-15/h5-6,9-10,16H,3-4,7-8H2,1-2H3,(H,17,20)