1-dodecoxy-1-phenoxycarbonyl-piperidin-1-ium-4-carboxylic acid

Systemtic Name: 1-dodecoxy-1-phenoxycarbonyl-piperidin-1-ium-4-carboxylic acid Openeye Name: 1-dodecoxy-1-phenoxycarbonyl-piperidin-1-ium-4-carboxylic acid CAS Name: 1-dodecoxy-1-[oxo(phenoxy)methyl]-4-piperidin-1-iumcarboxylic acid IUPAC Name: 1-dodecoxy-1-phenoxycarbonylpiperidin-1-ium-4-carboxylic acid Traditional Name: 1-carbophenoxy-1-lauryloxy-piperidin-1-ium-4-carboxylic acid Formula: C25H40NO5+ MolecularWeight: 434.5888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCO[N+]1(CCC(CC1)C(=O)O)C(=O)OC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCO[N+]1(CCC(CC1)C(=O)O)C(=O)OC2=CC=CC=C2

InChI

InChI=1S/C25H39NO5/c1-2-3-4-5-6-7-8-9-10-14-21-30-26(19-17-22(18-20-26)24(27)28)25(29)31-23-15-12-11-13-16-23/h11-13,15-16,22H,2-10,14,17-21H2,1H3/p+1