N-[4-(3-methylpyrazol-1-yl)phenyl]-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide

Systemtic Name: N-[4-(3-methylpyrazol-1-yl)phenyl]-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide Openeye Name: N-[4-(3-methylpyrazol-1-yl)phenyl]-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide CAS Name: N-[4-(3-methyl-1-pyrazolyl)phenyl]-5-(1-pyrrolidin-1-iumylmethyl)-2-furancarboxamide IUPAC Name: N-[4-(3-methylpyrazol-1-yl)phenyl]-5-(pyrrolidin-1-ium-1-ylmethyl)furan-2-carboxamide Traditional Name: N-[4-(3-methylpyrazol-1-yl)phenyl]-5-(pyrrolidin-1-ium-1-ylmethyl)-2-furamide Formula: C20H23N4O2+ MolecularWeight: 351.42222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1)C2=CC=C(C=C2)NC(=O)C3=CC=C(O3)C[NH+]4CCCC4

Isomeric SMILES

CC1=NN(C=C1)C2=CC=C(C=C2)NC(=O)C3=CC=C(O3)C[NH+]4CCCC4

InChI

InChI=1S/C20H22N4O2/c1-15-10-13-24(22-15)17-6-4-16(5-7-17)21-20(25)19-9-8-18(26-19)14-23-11-2-3-12-23/h4-10,13H,2-3,11-12,14H2,1H3,(H,21,25)/p+1