ethyl 2-[2-[(4-ethoxyphenyl)amino]-3-(2-hydroxyethyl)-1,3-thiazol-3-ium-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[(4-ethoxyphenyl)amino]-3-(2-hydroxyethyl)-1,3-thiazol-3-ium-4-yl]ethanoate Openeye Name: ethyl 2-[2-(4-ethoxyanilino)-3-(2-hydroxyethyl)thiazol-3-ium-4-yl]acetate CAS Name: 2-[2-(4-ethoxyanilino)-3-(2-hydroxyethyl)-4-thiazol-3-iumyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(4-ethoxyanilino)-3-(2-hydroxyethyl)-1,3-thiazol-3-ium-4-yl]acetate Traditional Name: 2-[3-(2-hydroxyethyl)-2-(p-phenetidino)thiazol-3-ium-4-yl]acetic acid ethyl ester Formula: C17H23N2O4S+ MolecularWeight: 351.44052

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=[N+](C(=CS2)CC(=O)OCC)CCO

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=[N+](C(=CS2)CC(=O)OCC)CCO

InChI

InChI=1S/C17H22N2O4S/c1-3-22-15-7-5-13(6-8-15)18-17-19(9-10-20)14(12-24-17)11-16(21)23-4-2/h5-8,12,20H,3-4,9-11H2,1-2H3/p+1