trimethyl-[4-[2-oxidanylidene-2-[8-[2-(phenylcarbamoyl)phenoxy]octoxy]ethyl]phenyl]azanium iodide

Systemtic Name: trimethyl-[4-[2-oxidanylidene-2-[8-[2-(phenylcarbamoyl)phenoxy]octoxy]ethyl]phenyl]azanium iodide Openeye Name: trimethyl-[4-[2-oxo-2-[8-[2-(phenylcarbamoyl)phenoxy]octoxy]ethyl]phenyl]ammonium iodide CAS Name: [4-[2-[8-[2-[anilino(oxo)methyl]phenoxy]octoxy]-2-oxoethyl]phenyl]-trimethylammonium iodide IUPAC Name: trimethyl-[4-[2-oxo-2-[8-[2-(phenylcarbamoyl)phenoxy]octoxy]ethyl]phenyl]azanium iodide Traditional Name: [4-[2-keto-2-[8-[2-(phenylcarbamoyl)phenoxy]octoxy]ethyl]phenyl]-trimethyl-ammonium iodide Formula: C32H41IN2O4 MolecularWeight: 644.58341

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C1=CC=C(C=C1)CC(=O)OCCCCCCCCOC2=CC=CC=C2C(=O)NC3=CC=CC=C3.[I-]

Isomeric SMILES

C[N+](C)(C)C1=CC=C(C=C1)CC(=O)OCCCCCCCCOC2=CC=CC=C2C(=O)NC3=CC=CC=C3.[I-]

InChI

InChI=1S/C32H40N2O4.HI/c1-34(2,3)28-21-19-26(20-22-28)25-31(35)38-24-14-7-5-4-6-13-23-37-30-18-12-11-17-29(30)32(36)33-27-15-9-8-10-16-27;/h8-12,15-22H,4-7,13-14,23-25H2,1-3H3;1H