[5-[(4-chloranylpyrazol-1-yl)methyl]furan-2-yl]-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [5-[(4-chloranylpyrazol-1-yl)methyl]furan-2-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: [5-[(4-chloropyrazol-1-yl)methyl]-2-furyl]-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: [5-[(4-chloro-1-pyrazolyl)methyl]-2-furanyl]-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: [5-[(4-chloropyrazol-1-yl)methyl]furan-2-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: [5-[(4-chloropyrazol-1-yl)methyl]-2-furyl]-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C14H18ClN4O2+ MolecularWeight: 309.77132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=CC=C(O2)CN3C=C(C=N3)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=CC=C(O2)CN3C=C(C=N3)Cl

InChI

InChI=1S/C14H17ClN4O2/c1-17-4-6-18(7-5-17)14(20)13-3-2-12(21-13)10-19-9-11(15)8-16-19/h2-3,8-9H,4-7,10H2,1H3/p+1