[1-[6-oxidanylidene-1-(3-phenylmethoxypropyl)pyridazin-4-yl]piperidin-4-yl]methylazanium

Systemtic Name: [1-[6-oxidanylidene-1-(3-phenylmethoxypropyl)pyridazin-4-yl]piperidin-4-yl]methylazanium Openeye Name: [1-[1-(3-benzyloxypropyl)-6-oxo-pyridazin-4-yl]-4-piperidyl]methylammonium CAS Name: [1-[6-oxo-1-(3-phenylmethoxypropyl)-4-pyridazinyl]-4-piperidinyl]methylammonium IUPAC Name: [1-[6-oxo-1-(3-phenylmethoxypropyl)pyridazin-4-yl]piperidin-4-yl]methylazanium Traditional Name: [1-[1-(3-benzoxypropyl)-6-keto-pyridazin-4-yl]-4-piperidyl]methylammonium Formula: C20H29N4O2+ MolecularWeight: 357.46986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C[NH3+])C2=CC(=O)N(N=C2)CCCOCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1C[NH3+])C2=CC(=O)N(N=C2)CCCOCC3=CC=CC=C3

InChI

InChI=1S/C20H28N4O2/c21-14-17-7-10-23(11-8-17)19-13-20(25)24(22-15-19)9-4-12-26-16-18-5-2-1-3-6-18/h1-3,5-6,13,15,17H,4,7-12,14,16,21H2/p+1