3-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-(2-phenoxyethanoyl)amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-(2-phenoxyethanoyl)amino]propyl-dimethyl-azanium Openeye Name: 3-[[4-(4-methoxyphenyl)thiazol-2-yl]-(2-phenoxyacetyl)amino]propyl-dimethyl-ammonium CAS Name: 3-[[4-(4-methoxyphenyl)-2-thiazolyl]-(1-oxo-2-phenoxyethyl)amino]propyl-dimethylammonium IUPAC Name: 3-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-(2-phenoxyacetyl)amino]propyl-dimethylazanium Traditional Name: 3-[[4-(4-methoxyphenyl)thiazol-2-yl]-(2-phenoxyacetyl)amino]propyl-dimethyl-ammonium Formula: C23H28N3O3S+ MolecularWeight: 426.55172

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCN(C1=NC(=CS1)C2=CC=C(C=C2)OC)C(=O)COC3=CC=CC=C3

Isomeric SMILES

C[NH+](C)CCCN(C1=NC(=CS1)C2=CC=C(C=C2)OC)C(=O)COC3=CC=CC=C3

InChI

InChI=1S/C23H27N3O3S/c1-25(2)14-7-15-26(22(27)16-29-20-8-5-4-6-9-20)23-24-21(17-30-23)18-10-12-19(28-3)13-11-18/h4-6,8-13,17H,7,14-16H2,1-3H3/p+1