N-(4-pyrazol-1-ylphenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide

Systemtic Name: N-(4-pyrazol-1-ylphenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide Openeye Name: N-(4-pyrazol-1-ylphenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide CAS Name: N-[4-(1-pyrazolyl)phenyl]-5-(1-pyrrolidin-1-iumylmethyl)-2-furancarboxamide IUPAC Name: N-(4-pyrazol-1-ylphenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide Traditional Name: N-(4-pyrazol-1-ylphenyl)-5-(pyrrolidin-1-ium-1-ylmethyl)-2-furamide Formula: C19H21N4O2+ MolecularWeight: 337.39564

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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=CC=N4

Isomeric SMILES

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

InChI

InChI=1S/C19H20N4O2/c24-19(18-9-8-17(25-18)14-22-11-1-2-12-22)21-15-4-6-16(7-5-15)23-13-3-10-20-23/h3-10,13H,1-2,11-12,14H2,(H,21,24)/p+1