(2S)-1-propyl-N-[3-(1,2,3,4-tetrazol-1-yl)phenyl]pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S)-1-propyl-N-[3-(1,2,3,4-tetrazol-1-yl)phenyl]pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S)-1-propyl-N-[3-(tetrazol-1-yl)phenyl]pyrrolidin-1-ium-2-carboxamide CAS Name: (2S)-1-propyl-N-[3-(1-tetrazolyl)phenyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S)-1-propyl-N-[3-(tetrazol-1-yl)phenyl]pyrrolidin-1-ium-2-carboxamide Traditional Name: (2S)-1-propyl-N-[3-(tetrazol-1-yl)phenyl]pyrrolidin-1-ium-2-carboxamide Formula: C15H21N6O+ MolecularWeight: 301.36684

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCCC1C(=O)NC2=CC=CC(=C2)N3C=NN=N3

Isomeric SMILES

CCC[NH+]1CCC[C@H]1C(=O)NC2=CC=CC(=C2)N3C=NN=N3

InChI

InChI=1S/C15H20N6O/c1-2-8-20-9-4-7-14(20)15(22)17-12-5-3-6-13(10-12)21-11-16-18-19-21/h3,5-6,10-11,14H,2,4,7-9H2,1H3,(H,17,22)/p+1/t14-/m0/s1