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

Systemtic Name: 4-methyl-3-(3-nitro-4-propyl-phenyl)-4,5-dihydro-1H-pyridazin-6-one Openeye Name: 4-methyl-3-(3-nitro-4-propyl-phenyl)-4,5-dihydro-1H-pyridazin-6-one CAS Name: 4-methyl-3-(3-nitro-4-propylphenyl)-4,5-dihydro-1H-pyridazin-6-one IUPAC Name: 4-methyl-3-(3-nitro-4-propylphenyl)-4,5-dihydro-1H-pyridazin-6-one Traditional Name: 4-methyl-3-(3-nitro-4-propyl-phenyl)-4,5-dihydro-1H-pyridazin-6-one Formula: C14H17N3O3 MolecularWeight: 275.30308

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(C=C1)C2=NNC(=O)CC2C)[N+](=O)[O-]

Isomeric SMILES

CCCC1=C(C=C(C=C1)C2=NNC(=O)CC2C)[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O3/c1-3-4-10-5-6-11(8-12(10)17(19)20)14-9(2)7-13(18)15-16-14/h5-6,8-9H,3-4,7H2,1-2H3,(H,15,18)