[(2R)-2-(benzotriazol-1-ylmethyl)-3-ethoxy-3-oxidanylidene-propyl]-dimethyl-azanium

Systemtic Name: [(2R)-2-(benzotriazol-1-ylmethyl)-3-ethoxy-3-oxidanylidene-propyl]-dimethyl-azanium Openeye Name: [(2R)-2-(benzotriazol-1-ylmethyl)-3-ethoxy-3-oxo-propyl]-dimethyl-ammonium CAS Name: [(2R)-2-(1-benzotriazolylmethyl)-3-ethoxy-3-oxopropyl]-dimethylammonium IUPAC Name: [(2R)-2-(benzotriazol-1-ylmethyl)-3-ethoxy-3-oxopropyl]-dimethylazanium Traditional Name: [(2R)-2-(benzotriazol-1-ylmethyl)-3-ethoxy-3-keto-propyl]-dimethyl-ammonium Formula: C14H21N4O2+ MolecularWeight: 277.34214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CN1C2=CC=CC=C2N=N1)C[NH+](C)C

Isomeric SMILES

CCOC(=O)[C@@H](CN1C2=CC=CC=C2N=N1)C[NH+](C)C

InChI

InChI=1S/C14H20N4O2/c1-4-20-14(19)11(9-17(2)3)10-18-13-8-6-5-7-12(13)15-16-18/h5-8,11H,4,9-10H2,1-3H3/p+1/t11-/m1/s1