N-[4-(4-chloranylpyrazol-1-yl)phenyl]-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide

Systemtic Name: N-[4-(4-chloranylpyrazol-1-yl)phenyl]-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide Openeye Name: N-[4-(4-chloropyrazol-1-yl)phenyl]-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide CAS Name: N-[4-(4-chloro-1-pyrazolyl)phenyl]-5-(1-pyrrolidin-1-iumylmethyl)-2-furancarboxamide IUPAC Name: N-[4-(4-chloropyrazol-1-yl)phenyl]-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide Traditional Name: N-[4-(4-chloropyrazol-1-yl)phenyl]-5-(pyrrolidin-1-ium-1-ylmethyl)-2-furamide Formula: C19H20ClN4O2+ MolecularWeight: 371.8407

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(O2)C(=O)NC3=CC=C(C=C3)N4C=C(C=N4)Cl

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(O2)C(=O)NC3=CC=C(C=C3)N4C=C(C=N4)Cl

InChI

InChI=1S/C19H19ClN4O2/c20-14-11-21-24(12-14)16-5-3-15(4-6-16)22-19(25)18-8-7-17(26-18)13-23-9-1-2-10-23/h3-8,11-12H,1-2,9-10,13H2,(H,22,25)/p+1