ethyl 4-[[3-(3-methoxypropyl)-4-methyl-1,3-thiazol-3-ium-2-yl]amino]benzoate

Systemtic Name: ethyl 4-[[3-(3-methoxypropyl)-4-methyl-1,3-thiazol-3-ium-2-yl]amino]benzoate Openeye Name: ethyl 4-[[3-(3-methoxypropyl)-4-methyl-thiazol-3-ium-2-yl]amino]benzoate CAS Name: 4-[[3-(3-methoxypropyl)-4-methyl-2-thiazol-3-iumyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-(3-methoxypropyl)-4-methyl-1,3-thiazol-3-ium-2-yl]amino]benzoate Traditional Name: 4-[[3-(3-methoxypropyl)-4-methyl-thiazol-3-ium-2-yl]amino]benzoic acid ethyl ester Formula: C17H23N2O3S+ MolecularWeight: 335.44112

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC2=[N+](C(=CS2)C)CCCOC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2=[N+](C(=CS2)C)CCCOC

InChI

InChI=1S/C17H22N2O3S/c1-4-22-16(20)14-6-8-15(9-7-14)18-17-19(10-5-11-21-3)13(2)12-23-17/h6-9,12H,4-5,10-11H2,1-3H3/p+1