(3-ethoxycarbonylphenyl)-dimethyl-(2-octoxyethanoylamino)azanium

Systemtic Name: (3-ethoxycarbonylphenyl)-dimethyl-(2-octoxyethanoylamino)azanium Openeye Name: (3-ethoxycarbonylphenyl)-dimethyl-[(2-octoxyacetyl)amino]ammonium CAS Name: (3-ethoxycarbonylphenyl)-dimethyl-[(2-octoxy-1-oxoethyl)amino]ammonium IUPAC Name: (3-ethoxycarbonylphenyl)-dimethyl-[(2-octoxyacetyl)amino]azanium Traditional Name: (3-carbethoxyphenyl)-dimethyl-[(2-octoxyacetyl)amino]ammonium Formula: C21H35N2O4+ MolecularWeight: 379.5136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H34N2O4/c1-5-7-8-9-10-11-15-26-17-20(24)22-23(3,4)19-14-12-13-18(16-19)21(25)27-6-2/h12-14,16H,5-11,15,17H2,1-4H3/p+1