N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]-2-(1,2,4-triazol-1-yl)ethanamide

Systemtic Name: N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]-2-(1,2,4-triazol-1-yl)ethanamide Openeye Name: N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]-2-(1,2,4-triazol-1-yl)acetamide CAS Name: N-[(2R)-2-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]-2-(1,2,4-triazol-1-yl)acetamide IUPAC Name: N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-ylethyl]-2-(1,2,4-triazol-1-yl)acetamide Traditional Name: N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]-2-(1,2,4-triazol-1-yl)acetamide Formula: C16H22N5O+ MolecularWeight: 300.37878

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=O)CN2C=NC=N2)C3=CC=CC=C3

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CNC(=O)CN2C=NC=N2)C3=CC=CC=C3

InChI

InChI=1S/C16H21N5O/c22-16(11-21-13-17-12-19-21)18-10-15(20-8-4-5-9-20)14-6-2-1-3-7-14/h1-3,6-7,12-13,15H,4-5,8-11H2,(H,18,22)/p+1/t15-/m0/s1