ethanoyl-(4-methoxycarbonylphenyl)-methyl-(2-octoxyethanoylamino)azanium

Systemtic Name: ethanoyl-(4-methoxycarbonylphenyl)-methyl-(2-octoxyethanoylamino)azanium Openeye Name: acetyl-(4-methoxycarbonylphenyl)-methyl-[(2-octoxyacetyl)amino]ammonium CAS Name: acetyl-(4-methoxycarbonylphenyl)-methyl-[(2-octoxy-1-oxoethyl)amino]ammonium IUPAC Name: acetyl-(4-methoxycarbonylphenyl)-methyl-[(2-octoxyacetyl)amino]azanium Traditional Name: acetyl-(4-carbomethoxyphenyl)-methyl-[(2-octoxyacetyl)amino]ammonium Formula: C21H33N2O5+ MolecularWeight: 393.49712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H32N2O5/c1-5-6-7-8-9-10-15-28-16-20(25)22-23(3,17(2)24)19-13-11-18(12-14-19)21(26)27-4/h11-14H,5-10,15-16H2,1-4H3/p+1