dimethyl-[(2-methylpropan-2-yl)oxycarbonyl]-[(E)-pentadec-1-enyl]azanium; 1,3-dioxane

Systemtic Name: dimethyl-[(2-methylpropan-2-yl)oxycarbonyl]-[(E)-pentadec-1-enyl]azanium; 1,3-dioxane Openeye Name: tert-butoxycarbonyl-dimethyl-[(E)-pentadec-1-enyl]ammonium; 1,3-dioxane CAS Name: dimethyl-[(2-methylpropan-2-yl)oxy-oxomethyl]-[(E)-pentadec-1-enyl]ammonium; 1,3-dioxane IUPAC Name: dimethyl-[(2-methylpropan-2-yl)oxycarbonyl]-[(E)-pentadec-1-enyl]azanium; 1,3-dioxane Traditional Name: tert-butoxycarbonyl-dimethyl-[(E)-pentadec-1-enyl]ammonium; 1,3-dioxane Formula: C26H52NO4+ MolecularWeight: 442.69538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=C[N+](C)(C)C(=O)OC(C)(C)C.C1COCOC1

Isomeric SMILES

CCCCCCCCCCCCC/C=C/[N+](C)(C)C(=O)OC(C)(C)C.C1COCOC1

InChI

InChI=1S/C22H44NO2.C4H8O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(5,6)21(24)25-22(2,3)4;1-2-5-4-6-3-1/h19-20H,7-18H2,1-6H3;1-4H2/q+1;/b20-19+;