N-[[(3R)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]methyl]pyridazine-4-carboxamide

Systemtic Name: N-[[(3R)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]methyl]pyridazine-4-carboxamide Openeye Name: N-[[(3R)-1-benzylpyrrolidin-1-ium-3-yl]methyl]pyridazine-4-carboxamide CAS Name: N-[[(3R)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]methyl]-4-pyridazinecarboxamide IUPAC Name: N-[[(3R)-1-benzylpyrrolidin-1-ium-3-yl]methyl]pyridazine-4-carboxamide Traditional Name: N-[[(3R)-1-benzylpyrrolidin-1-ium-3-yl]methyl]pyridazine-4-carboxamide Formula: C17H21N4O+ MolecularWeight: 297.37484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC1CNC(=O)C2=CN=NC=C2)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](C[C@H]1CNC(=O)C2=CN=NC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C17H20N4O/c22-17(16-6-8-19-20-11-16)18-10-15-7-9-21(13-15)12-14-4-2-1-3-5-14/h1-6,8,11,15H,7,9-10,12-13H2,(H,18,22)/p+1/t15-/m1/s1