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

Systemtic Name: [5-[(4-chloranylpyrazol-1-yl)methyl]furan-2-yl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Openeye Name: [5-[(4-chloropyrazol-1-yl)methyl]-2-furyl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone CAS Name: [5-[(4-chloro-1-pyrazolyl)methyl]-2-furanyl]-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methanone IUPAC Name: [5-[(4-chloropyrazol-1-yl)methyl]furan-2-yl]-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanone Traditional Name: [5-[(4-chloropyrazol-1-yl)methyl]-2-furyl]-(4-pyridin-1-ium-2-ylpiperazino)methanone Formula: C18H19ClN5O2+ MolecularWeight: 372.82876

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=CC=C(O3)CN4C=C(C=N4)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=CC=C(O3)CN4C=C(C=N4)Cl

InChI

InChI=1S/C18H18ClN5O2/c19-14-11-21-24(12-14)13-15-4-5-16(26-15)18(25)23-9-7-22(8-10-23)17-3-1-2-6-20-17/h1-6,11-12H,7-10,13H2/p+1