(4-ethoxycarbonylphenyl)-hexyl-methyl-(2-octoxyethanoylamino)azanium

Systemtic Name: (4-ethoxycarbonylphenyl)-hexyl-methyl-(2-octoxyethanoylamino)azanium Openeye Name: (4-ethoxycarbonylphenyl)-hexyl-methyl-[(2-octoxyacetyl)amino]ammonium CAS Name: (4-ethoxycarbonylphenyl)-hexyl-methyl-[(2-octoxy-1-oxoethyl)amino]ammonium IUPAC Name: (4-ethoxycarbonylphenyl)-hexyl-methyl-[(2-octoxyacetyl)amino]azanium Traditional Name: (4-carbethoxyphenyl)-hexyl-methyl-[(2-octoxyacetyl)amino]ammonium Formula: C26H45N2O4+ MolecularWeight: 449.6465

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOCC(=O)N[N+](C)(CCCCCC)C1=CC=C(C=C1)C(=O)OCC

Isomeric SMILES

CCCCCCCCOCC(=O)N[N+](C)(CCCCCC)C1=CC=C(C=C1)C(=O)OCC

InChI

InChI=1S/C26H44N2O4/c1-5-8-10-12-13-15-21-31-22-25(29)27-28(4,20-14-11-9-6-2)24-18-16-23(17-19-24)26(30)32-7-3/h16-19H,5-15,20-22H2,1-4H3/p+1