methyl (2S,4S)-4-[4-(2-methoxyethyl)phenoxy]pyrrolidin-1-ium-2-carboxylate

Systemtic Name: methyl (2S,4S)-4-[4-(2-methoxyethyl)phenoxy]pyrrolidin-1-ium-2-carboxylate Openeye Name: methyl (2S,4S)-4-[4-(2-methoxyethyl)phenoxy]pyrrolidin-1-ium-2-carboxylate CAS Name: (2S,4S)-4-[4-(2-methoxyethyl)phenoxy]-2-pyrrolidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl (2S,4S)-4-[4-(2-methoxyethyl)phenoxy]pyrrolidin-1-ium-2-carboxylate Traditional Name: (2S,4S)-4-[4-(2-methoxyethyl)phenoxy]pyrrolidin-1-ium-2-carboxylic acid methyl ester Formula: C15H22NO4+ MolecularWeight: 280.33948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCC1=CC=C(C=C1)OC2CC([NH2+]C2)C(=O)OC

Isomeric SMILES

COCCC1=CC=C(C=C1)O[C@H]2C[C@H]([NH2+]C2)C(=O)OC

InChI

InChI=1S/C15H21NO4/c1-18-8-7-11-3-5-12(6-4-11)20-13-9-14(16-10-13)15(17)19-2/h3-6,13-14,16H,7-10H2,1-2H3/p+1/t13-,14-/m0/s1