ethyl (2R)-1-(anthracen-9-ylmethyl)piperidin-1-ium-2-carboxylate

Systemtic Name: ethyl (2R)-1-(anthracen-9-ylmethyl)piperidin-1-ium-2-carboxylate Openeye Name: ethyl (2R)-1-(9-anthrylmethyl)piperidin-1-ium-2-carboxylate CAS Name: (2R)-1-(9-anthracenylmethyl)-2-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (2R)-1-(anthracen-9-ylmethyl)piperidin-1-ium-2-carboxylate Traditional Name: (2R)-1-(9-anthrylmethyl)piperidin-1-ium-2-carboxylic acid ethyl ester Formula: C23H26NO2+ MolecularWeight: 348.45804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCC[NH+]1CC2=C3C=CC=CC3=CC4=CC=CC=C42

Isomeric SMILES

CCOC(=O)[C@H]1CCCC[NH+]1CC2=C3C=CC=CC3=CC4=CC=CC=C42

InChI

InChI=1S/C23H25NO2/c1-2-26-23(25)22-13-7-8-14-24(22)16-21-19-11-5-3-9-17(19)15-18-10-4-6-12-20(18)21/h3-6,9-12,15,22H,2,7-8,13-14,16H2,1H3/p+1/t22-/m1/s1