N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-[(2R)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-phenyl-triazole-4-carboxamide CAS Name: N-[(2R)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-2-phenyl-4-triazolecarboxamide IUPAC Name: N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]-2-phenyltriazole-4-carboxamide Traditional Name: N-[(2R)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-phenyl-triazole-4-carboxamide Formula: C19H22N5O2+ MolecularWeight: 352.41028

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=O)C2=NN(N=C2)C3=CC=CC=C3)C4=CC=CO4

Isomeric SMILES

C1CC[NH+](C1)[C@H](CNC(=O)C2=NN(N=C2)C3=CC=CC=C3)C4=CC=CO4

InChI

InChI=1S/C19H21N5O2/c25-19(16-13-21-24(22-16)15-7-2-1-3-8-15)20-14-17(18-9-6-12-26-18)23-10-4-5-11-23/h1-3,6-9,12-13,17H,4-5,10-11,14H2,(H,20,25)/p+1/t17-/m1/s1