(1-ethoxy-1-oxidanylidene-dodecan-2-yl)-dimethyl-(phenylmethyl)azanium

Systemtic Name: (1-ethoxy-1-oxidanylidene-dodecan-2-yl)-dimethyl-(phenylmethyl)azanium Openeye Name: benzyl-(1-ethoxycarbonylundecyl)-dimethyl-ammonium CAS Name: (1-ethoxy-1-oxododecan-2-yl)-dimethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-(1-ethoxy-1-oxododecan-2-yl)-dimethylazanium Traditional Name: benzyl-(1-carbethoxyundecyl)-dimethyl-ammonium Formula: C23H40NO2+ MolecularWeight: 362.5692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C(=O)OCC)[N+](C)(C)CC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCC(C(=O)OCC)[N+](C)(C)CC1=CC=CC=C1

InChI

InChI=1S/C23H40NO2/c1-5-7-8-9-10-11-12-16-19-22(23(25)26-6-2)24(3,4)20-21-17-14-13-15-18-21/h13-15,17-18,22H,5-12,16,19-20H2,1-4H3/q+1