2-[5-chloranyl-6-oxidanylidene-4-[(phenylmethyl)amino]pyridazin-1-yl]ethyl-diethyl-azanium

Systemtic Name: 2-[5-chloranyl-6-oxidanylidene-4-[(phenylmethyl)amino]pyridazin-1-yl]ethyl-diethyl-azanium Openeye Name: 2-[4-(benzylamino)-5-chloro-6-oxo-pyridazin-1-yl]ethyl-diethyl-ammonium CAS Name: 2-[5-chloro-6-oxo-4-[(phenylmethyl)amino]-1-pyridazinyl]ethyl-diethylammonium IUPAC Name: 2-[4-(benzylamino)-5-chloro-6-oxopyridazin-1-yl]ethyl-diethylazanium Traditional Name: 2-[4-(benzylamino)-5-chloro-6-keto-pyridazin-1-yl]ethyl-diethyl-ammonium Formula: C17H24ClN4O+ MolecularWeight: 335.85166

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C(=O)C(=C(C=N1)NCC2=CC=CC=C2)Cl

Isomeric SMILES

CC[NH+](CC)CCN1C(=O)C(=C(C=N1)NCC2=CC=CC=C2)Cl

InChI

InChI=1S/C17H23ClN4O/c1-3-21(4-2)10-11-22-17(23)16(18)15(13-20-22)19-12-14-8-6-5-7-9-14/h5-9,13,19H,3-4,10-12H2,1-2H3/p+1