[4-[3,3-diethyl-4-oxidanylidene-1-[(phenylmethyl)carbamoyl]azetidin-2-yl]oxyphenyl]methyl-trimethyl-azanium iodide

Systemtic Name: [4-[3,3-diethyl-4-oxidanylidene-1-[(phenylmethyl)carbamoyl]azetidin-2-yl]oxyphenyl]methyl-trimethyl-azanium iodide Openeye Name: [4-[1-(benzylcarbamoyl)-3,3-diethyl-4-oxo-azetidin-2-yl]oxyphenyl]methyl-trimethyl-ammonium iodide CAS Name: [4-[[3,3-diethyl-4-oxo-1-[oxo-[(phenylmethyl)amino]methyl]-2-azetidinyl]oxy]phenyl]methyl-trimethylammonium iodide IUPAC Name: [4-[1-(benzylcarbamoyl)-3,3-diethyl-4-oxoazetidin-2-yl]oxyphenyl]methyl-trimethylazanium iodide Traditional Name: [4-[1-(benzylcarbamoyl)-3,3-diethyl-4-keto-azetidin-2-yl]oxybenzyl]-trimethyl-ammonium iodide Formula: C25H34IN3O3 MolecularWeight: 551.46023

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(N(C1=O)C(=O)NCC2=CC=CC=C2)OC3=CC=C(C=C3)C[N+](C)(C)C)CC.[I-]

Isomeric SMILES

CCC1(C(N(C1=O)C(=O)NCC2=CC=CC=C2)OC3=CC=C(C=C3)C[N+](C)(C)C)CC.[I-]

InChI

InChI=1S/C25H33N3O3.HI/c1-6-25(7-2)22(29)27(24(30)26-17-19-11-9-8-10-12-19)23(25)31-21-15-13-20(14-16-21)18-28(3,4)5;/h8-16,23H,6-7,17-18H2,1-5H3;1H