2-[4-[5-chloranyl-6-oxidanylidene-1-(phenylmethyl)pyridazin-4-yl]piperazin-1-yl]ethylazanium

Systemtic Name: 2-[4-[5-chloranyl-6-oxidanylidene-1-(phenylmethyl)pyridazin-4-yl]piperazin-1-yl]ethylazanium Openeye Name: 2-[4-(1-benzyl-5-chloro-6-oxo-pyridazin-4-yl)piperazin-1-yl]ethylammonium CAS Name: 2-[4-[5-chloro-6-oxo-1-(phenylmethyl)-4-pyridazinyl]-1-piperazinyl]ethylammonium IUPAC Name: 2-[4-(1-benzyl-5-chloro-6-oxopyridazin-4-yl)piperazin-1-yl]ethylazanium Traditional Name: 2-[4-(1-benzyl-5-chloro-6-keto-pyridazin-4-yl)piperazino]ethylammonium Formula: C17H23ClN5O+ MolecularWeight: 348.85042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC[NH3+])C2=C(C(=O)N(N=C2)CC3=CC=CC=C3)Cl

Isomeric SMILES

C1CN(CCN1CC[NH3+])C2=C(C(=O)N(N=C2)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C17H22ClN5O/c18-16-15(22-10-8-21(7-6-19)9-11-22)12-20-23(17(16)24)13-14-4-2-1-3-5-14/h1-5,12H,6-11,13,19H2/p+1