3-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl-6-methyl-1-(2-nitrophenyl)pyridazin-4-one

Systemtic Name: 3-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl-6-methyl-1-(2-nitrophenyl)pyridazin-4-one Openeye Name: 3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-6-methyl-1-(2-nitrophenyl)pyridazin-4-one CAS Name: 3-[[4-(2,3-dimethylphenyl)-1-piperazinyl]-oxomethyl]-6-methyl-1-(2-nitrophenyl)-4-pyridazinone IUPAC Name: 3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-6-methyl-1-(2-nitrophenyl)pyridazin-4-one Traditional Name: 3-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-6-methyl-1-(2-nitrophenyl)pyridazin-4-one Formula: C24H25N5O4 MolecularWeight: 447.4864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=NN(C(=CC3=O)C)C4=CC=CC=C4[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=NN(C(=CC3=O)C)C4=CC=CC=C4[N+](=O)[O-])C

InChI

InChI=1S/C24H25N5O4/c1-16-7-6-10-19(18(16)3)26-11-13-27(14-12-26)24(31)23-22(30)15-17(2)28(25-23)20-8-4-5-9-21(20)29(32)33/h4-10,15H,11-14H2,1-3H3