diethyl-[2-(6-oxidanylidene-3,4,5-triphenyl-pyridazin-1-yl)ethyl]azanium chloride

Systemtic Name: diethyl-[2-(6-oxidanylidene-3,4,5-triphenyl-pyridazin-1-yl)ethyl]azanium chloride Openeye Name: diethyl-[2-(6-oxo-3,4,5-triphenyl-pyridazin-1-yl)ethyl]ammonium chloride CAS Name: diethyl-[2-(6-oxo-3,4,5-triphenyl-1-pyridazinyl)ethyl]ammonium chloride IUPAC Name: diethyl-[2-(6-oxo-3,4,5-triphenylpyridazin-1-yl)ethyl]azanium chloride Traditional Name: diethyl-[2-(6-keto-3,4,5-triphenyl-pyridazin-1-yl)ethyl]ammonium chloride Formula: C28H30ClN3O MolecularWeight: 460.0103

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C(=O)C(=C(C(=N1)C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

CC[NH+](CC)CCN1C(=O)C(=C(C(=N1)C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C28H29N3O.ClH/c1-3-30(4-2)20-21-31-28(32)26(23-16-10-6-11-17-23)25(22-14-8-5-9-15-22)27(29-31)24-18-12-7-13-19-24;/h5-19H,3-4,20-21H2,1-2H3;1H