diethyl-[5-(1H-imidazol-5-ylmethoxy)-5-oxidanylidene-pentyl]-(phenylmethyl)azanium

Systemtic Name: diethyl-[5-(1H-imidazol-5-ylmethoxy)-5-oxidanylidene-pentyl]-(phenylmethyl)azanium Openeye Name: benzyl-diethyl-[5-(1H-imidazol-5-ylmethoxy)-5-oxo-pentyl]ammonium CAS Name: diethyl-[5-(1H-imidazol-5-ylmethoxy)-5-oxopentyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-diethyl-[5-(1H-imidazol-5-ylmethoxy)-5-oxopentyl]azanium Traditional Name: benzyl-diethyl-[5-(1H-imidazol-5-ylmethoxy)-5-keto-pentyl]ammonium Formula: C20H30N3O2+ MolecularWeight: 344.4711

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CCCCC(=O)OCC1=CN=CN1)CC2=CC=CC=C2

Isomeric SMILES

CC[N+](CC)(CCCCC(=O)OCC1=CN=CN1)CC2=CC=CC=C2

InChI

InChI=1S/C20H30N3O2/c1-3-23(4-2,15-18-10-6-5-7-11-18)13-9-8-12-20(24)25-16-19-14-21-17-22-19/h5-7,10-11,14,17H,3-4,8-9,12-13,15-16H2,1-2H3,(H,21,22)/q+1