[(3S)-3-(benzotriazol-1-yl)-3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-diethyl-azanium

Systemtic Name: [(3S)-3-(benzotriazol-1-yl)-3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-diethyl-azanium Openeye Name: [(3S)-3-(benzotriazol-1-yl)-3-(2-oxopyrrolidin-1-yl)propyl]-diethyl-ammonium CAS Name: [(3S)-3-(1-benzotriazolyl)-3-(2-oxo-1-pyrrolidinyl)propyl]-diethylammonium IUPAC Name: [(3S)-3-(benzotriazol-1-yl)-3-(2-oxopyrrolidin-1-yl)propyl]-diethylazanium Traditional Name: [(3S)-3-(benzotriazol-1-yl)-3-(2-ketopyrrolidino)propyl]-diethyl-ammonium Formula: C17H26N5O+ MolecularWeight: 316.42124

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC(N1CCCC1=O)N2C3=CC=CC=C3N=N2

Isomeric SMILES

CC[NH+](CC)CC[C@@H](N1CCCC1=O)N2C3=CC=CC=C3N=N2

InChI

InChI=1S/C17H25N5O/c1-3-20(4-2)13-11-16(21-12-7-10-17(21)23)22-15-9-6-5-8-14(15)18-19-22/h5-6,8-9,16H,3-4,7,10-13H2,1-2H3/p+1/t16-/m0/s1