diethyl-[2-[6-oxidanylidene-3-(4-piperidin-1-ylphenyl)pyridazin-1-yl]ethyl]azanium

Systemtic Name: diethyl-[2-[6-oxidanylidene-3-(4-piperidin-1-ylphenyl)pyridazin-1-yl]ethyl]azanium Openeye Name: diethyl-[2-[6-oxo-3-[4-(1-piperidyl)phenyl]pyridazin-1-yl]ethyl]ammonium CAS Name: diethyl-[2-[6-oxo-3-[4-(1-piperidinyl)phenyl]-1-pyridazinyl]ethyl]ammonium IUPAC Name: diethyl-[2-[6-oxo-3-(4-piperidin-1-ylphenyl)pyridazin-1-yl]ethyl]azanium Traditional Name: diethyl-[2-[6-keto-3-(4-piperidinophenyl)pyridazin-1-yl]ethyl]ammonium Formula: C21H31N4O+ MolecularWeight: 355.49704

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C(=O)C=CC(=N1)C2=CC=C(C=C2)N3CCCCC3

Isomeric SMILES

CC[NH+](CC)CCN1C(=O)C=CC(=N1)C2=CC=C(C=C2)N3CCCCC3

InChI

InChI=1S/C21H30N4O/c1-3-23(4-2)16-17-25-21(26)13-12-20(22-25)18-8-10-19(11-9-18)24-14-6-5-7-15-24/h8-13H,3-7,14-17H2,1-2H3/p+1