(4-fluorophenyl)methyl 4-[(pyridazin-4-ylamino)methyl]piperidine-1-carboxylate

Systemtic Name: (4-fluorophenyl)methyl 4-[(pyridazin-4-ylamino)methyl]piperidine-1-carboxylate Openeye Name: (4-fluorophenyl)methyl 4-[(pyridazin-4-ylamino)methyl]piperidine-1-carboxylate CAS Name: 4-[(4-pyridazinylamino)methyl]-1-piperidinecarboxylic acid (4-fluorophenyl)methyl ester IUPAC Name: (4-fluorophenyl)methyl 4-[(pyridazin-4-ylamino)methyl]piperidine-1-carboxylate Traditional Name: 4-[(pyridazin-4-ylamino)methyl]piperidine-1-carboxylic acid (4-fluorobenzyl) ester Formula: C18H21FN4O2 MolecularWeight: 344.383343

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC2=CN=NC=C2)C(=O)OCC3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCC1CNC2=CN=NC=C2)C(=O)OCC3=CC=C(C=C3)F

InChI

InChI=1S/C18H21FN4O2/c19-16-3-1-15(2-4-16)13-25-18(24)23-9-6-14(7-10-23)11-20-17-5-8-21-22-12-17/h1-5,8,12,14H,6-7,9-11,13H2,(H,20,21)