trimethyl-[1-oxidanylidene-1-[[8-oxidanylidene-8-[(4-phenylmethoxyphenyl)amino]octyl]amino]-3-phenyl-propan-2-yl]azanium iodide

Systemtic Name: trimethyl-[1-oxidanylidene-1-[[8-oxidanylidene-8-[(4-phenylmethoxyphenyl)amino]octyl]amino]-3-phenyl-propan-2-yl]azanium iodide Openeye Name: [1-benzyl-2-[[8-(4-benzyloxyanilino)-8-oxo-octyl]amino]-2-oxo-ethyl]-trimethyl-ammonium iodide CAS Name: trimethyl-[1-oxo-1-[[8-oxo-8-(4-phenylmethoxyanilino)octyl]amino]-3-phenylpropan-2-yl]ammonium iodide IUPAC Name: trimethyl-[1-oxo-1-[[8-oxo-8-(4-phenylmethoxyanilino)octyl]amino]-3-phenylpropan-2-yl]azanium iodide Traditional Name: [2-[[8-(4-benzoxyanilino)-8-keto-octyl]amino]-1-benzyl-2-keto-ethyl]-trimethyl-ammonium iodide Formula: C33H44IN3O3 MolecularWeight: 657.62523

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C(CC1=CC=CC=C1)C(=O)NCCCCCCCC(=O)NC2=CC=C(C=C2)OCC3=CC=CC=C3.[I-]

Isomeric SMILES

C[N+](C)(C)C(CC1=CC=CC=C1)C(=O)NCCCCCCCC(=O)NC2=CC=C(C=C2)OCC3=CC=CC=C3.[I-]

InChI

InChI=1S/C33H43N3O3.HI/c1-36(2,3)31(25-27-15-9-7-10-16-27)33(38)34-24-14-6-4-5-13-19-32(37)35-29-20-22-30(23-21-29)39-26-28-17-11-8-12-18-28;/h7-12,15-18,20-23,31H,4-6,13-14,19,24-26H2,1-3H3,(H-,34,35,37,38);1H