N-[3-[[6-(3,4-dimethoxyphenyl)-2-oxidanidyl-4,5-dihydro-3H-pyridazin-2-ium-2-yl]methyl]phenyl]ethanamide

Systemtic Name: N-[3-[[6-(3,4-dimethoxyphenyl)-2-oxidanidyl-4,5-dihydro-3H-pyridazin-2-ium-2-yl]methyl]phenyl]ethanamide Openeye Name: N-[3-[[6-(3,4-dimethoxyphenyl)-2-oxido-4,5-dihydro-3H-pyridazin-2-ium-2-yl]methyl]phenyl]acetamide CAS Name: N-[3-[[6-(3,4-dimethoxyphenyl)-2-oxido-4,5-dihydro-3H-pyridazin-2-ium-2-yl]methyl]phenyl]acetamide IUPAC Name: N-[3-[[6-(3,4-dimethoxyphenyl)-2-oxido-4,5-dihydro-3H-pyridazin-2-ium-2-yl]methyl]phenyl]acetamide Traditional Name: N-[3-[[6-(3,4-dimethoxyphenyl)-2-oxido-4,5-dihydro-3H-pyridazin-2-ium-2-yl]methyl]phenyl]acetamide Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C[N+]2(CCCC(=N2)C3=CC(=C(C=C3)OC)OC)[O-]

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C[N+]2(CCCC(=N2)C3=CC(=C(C=C3)OC)OC)[O-]

InChI

InChI=1S/C21H25N3O4/c1-15(25)22-18-7-4-6-16(12-18)14-24(26)11-5-8-19(23-24)17-9-10-20(27-2)21(13-17)28-3/h4,6-7,9-10,12-13H,5,8,11,14H2,1-3H3,(H,22,25)