[1-[6-oxidanylidene-1-[2-(phenylcarbonyloxy)ethyl]pyridazin-4-yl]piperidin-4-yl]methylazanium

Systemtic Name: [1-[6-oxidanylidene-1-[2-(phenylcarbonyloxy)ethyl]pyridazin-4-yl]piperidin-4-yl]methylazanium Openeye Name: [1-[1-(2-benzoyloxyethyl)-6-oxo-pyridazin-4-yl]-4-piperidyl]methylammonium CAS Name: [1-[1-(2-benzoyloxyethyl)-6-oxo-4-pyridazinyl]-4-piperidinyl]methylammonium IUPAC Name: [1-[1-(2-benzoyloxyethyl)-6-oxopyridazin-4-yl]piperidin-4-yl]methylazanium Traditional Name: [1-[1-(2-benzoyloxyethyl)-6-keto-pyridazin-4-yl]-4-piperidyl]methylammonium Formula: C19H25N4O3+ MolecularWeight: 357.4268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24N4O3/c20-13-15-6-8-22(9-7-15)17-12-18(24)23(21-14-17)10-11-26-19(25)16-4-2-1-3-5-16/h1-5,12,14-15H,6-11,13,20H2/p+1