3-chloranyl-4-ethoxy-5-methoxy-N-[4-(piperidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]benzamide

Systemtic Name: 3-chloranyl-4-ethoxy-5-methoxy-N-[4-(piperidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]benzamide Openeye Name: 3-chloro-4-ethoxy-5-methoxy-N-[4-(piperidin-1-ium-1-ylmethyl)thiazol-2-yl]benzamide CAS Name: 3-chloro-4-ethoxy-5-methoxy-N-[4-(1-piperidin-1-iumylmethyl)-2-thiazolyl]benzamide IUPAC Name: 3-chloro-4-ethoxy-5-methoxy-N-[4-(piperidin-1-ium-1-ylmethyl)-1,3-thiazol-2-yl]benzamide Traditional Name: 3-chloro-4-ethoxy-5-methoxy-N-[4-(piperidin-1-ium-1-ylmethyl)thiazol-2-yl]benzamide Formula: C19H25ClN3O3S+ MolecularWeight: 410.9381

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C(=O)NC2=NC(=CS2)C[NH+]3CCCCC3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)C(=O)NC2=NC(=CS2)C[NH+]3CCCCC3)OC

InChI

InChI=1S/C19H24ClN3O3S/c1-3-26-17-15(20)9-13(10-16(17)25-2)18(24)22-19-21-14(12-27-19)11-23-7-5-4-6-8-23/h9-10,12H,3-8,11H2,1-2H3,(H,21,22,24)/p+1