[3-(3-chlorophenyl)-1-oxidanylidene-1-[8-(4-phenylmethoxyphenoxy)octylamino]propan-2-yl]-trimethyl-azanium

Systemtic Name: [3-(3-chlorophenyl)-1-oxidanylidene-1-[8-(4-phenylmethoxyphenoxy)octylamino]propan-2-yl]-trimethyl-azanium Openeye Name: [2-[8-(4-benzyloxyphenoxy)octylamino]-1-[(3-chlorophenyl)methyl]-2-oxo-ethyl]-trimethyl-ammonium CAS Name: [3-(3-chlorophenyl)-1-oxo-1-[8-(4-phenylmethoxyphenoxy)octylamino]propan-2-yl]-trimethylammonium IUPAC Name: [3-(3-chlorophenyl)-1-oxo-1-[8-(4-phenylmethoxyphenoxy)octylamino]propan-2-yl]-trimethylazanium Traditional Name: [2-[8-(4-benzoxyphenoxy)octylamino]-1-(3-chlorobenzyl)-2-keto-ethyl]-trimethyl-ammonium Formula: C33H44ClN2O3+ MolecularWeight: 552.16706

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C(CC1=CC(=CC=C1)Cl)C(=O)NCCCCCCCCOC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

C[N+](C)(C)C(CC1=CC(=CC=C1)Cl)C(=O)NCCCCCCCCOC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C33H43ClN2O3/c1-36(2,3)32(25-28-16-13-17-29(34)24-28)33(37)35-22-11-6-4-5-7-12-23-38-30-18-20-31(21-19-30)39-26-27-14-9-8-10-15-27/h8-10,13-21,24,32H,4-7,11-12,22-23,25-26H2,1-3H3/p+1