ethyl 1-[(2-morpholin-4-yl-1,3-thiazol-5-yl)methyl]-4-(phenylmethyl)piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[(2-morpholin-4-yl-1,3-thiazol-5-yl)methyl]-4-(phenylmethyl)piperidin-1-ium-4-carboxylate Openeye Name: ethyl 4-benzyl-1-[(2-morpholinothiazol-5-yl)methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[[2-(4-morpholinyl)-5-thiazolyl]methyl]-4-(phenylmethyl)-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-benzyl-1-[(2-morpholin-4-yl-1,3-thiazol-5-yl)methyl]piperidin-1-ium-4-carboxylate Traditional Name: 4-benzyl-1-[(2-morpholinothiazol-5-yl)methyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C23H32N3O3S+ MolecularWeight: 430.58348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC[NH+](CC1)CC2=CN=C(S2)N3CCOCC3)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1(CC[NH+](CC1)CC2=CN=C(S2)N3CCOCC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H31N3O3S/c1-2-29-21(27)23(16-19-6-4-3-5-7-19)8-10-25(11-9-23)18-20-17-24-22(30-20)26-12-14-28-15-13-26/h3-7,17H,2,8-16,18H2,1H3/p+1