trimethyl-[1-oxidanylidene-3-phenyl-1-[10-(4-phenylmethoxyphenoxy)dec-8-ynoxy]propan-2-yl]azanium

Systemtic Name: trimethyl-[1-oxidanylidene-3-phenyl-1-[10-(4-phenylmethoxyphenoxy)dec-8-ynoxy]propan-2-yl]azanium Openeye Name: [1-benzyl-2-[10-(4-benzyloxyphenoxy)dec-8-ynoxy]-2-oxo-ethyl]-trimethyl-ammonium CAS Name: trimethyl-[1-oxo-3-phenyl-1-[10-(4-phenylmethoxyphenoxy)dec-8-ynoxy]propan-2-yl]ammonium IUPAC Name: trimethyl-[1-oxo-3-phenyl-1-[10-(4-phenylmethoxyphenoxy)dec-8-ynoxy]propan-2-yl]azanium Traditional Name: [2-[10-(4-benzoxyphenoxy)dec-8-ynoxy]-1-benzyl-2-keto-ethyl]-trimethyl-ammonium Formula: C35H44NO4+ MolecularWeight: 542.72816

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C(CC1=CC=CC=C1)C(=O)OCCCCCCCC#CCOC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

C[N+](C)(C)C(CC1=CC=CC=C1)C(=O)OCCCCCCCC#CCOC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C35H44NO4/c1-36(2,3)34(28-30-18-12-10-13-19-30)35(37)39-27-17-9-7-5-4-6-8-16-26-38-32-22-24-33(25-23-32)40-29-31-20-14-11-15-21-31/h10-15,18-25,34H,4-7,9,17,26-29H2,1-3H3/q+1