ethyl (3S)-1-[[1-(2-morpholin-4-ylethyl)pyrrol-2-yl]methyl]piperidin-1-ium-3-carboxylate

Systemtic Name: ethyl (3S)-1-[[1-(2-morpholin-4-ylethyl)pyrrol-2-yl]methyl]piperidin-1-ium-3-carboxylate Openeye Name: ethyl (3S)-1-[[1-(2-morpholinoethyl)pyrrol-2-yl]methyl]piperidin-1-ium-3-carboxylate CAS Name: (3S)-1-[[1-[2-(4-morpholinyl)ethyl]-2-pyrrolyl]methyl]-3-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[[1-(2-morpholin-4-ylethyl)pyrrol-2-yl]methyl]piperidin-1-ium-3-carboxylate Traditional Name: (3S)-1-[[1-(2-morpholinoethyl)pyrrol-2-yl]methyl]piperidin-1-ium-3-carboxylic acid ethyl ester Formula: C19H32N3O3+ MolecularWeight: 350.47568

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC[NH+](C1)CC2=CC=CN2CCN3CCOCC3

Isomeric SMILES

CCOC(=O)[C@H]1CCC[NH+](C1)CC2=CC=CN2CCN3CCOCC3

InChI

InChI=1S/C19H31N3O3/c1-2-25-19(23)17-5-3-7-21(15-17)16-18-6-4-8-22(18)10-9-20-11-13-24-14-12-20/h4,6,8,17H,2-3,5,7,9-16H2,1H3/p+1/t17-/m0/s1