3-chloranyl-4-ethoxy-5-methoxy-N-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1,3-thiazol-2-yl]benzamide

Systemtic Name: 3-chloranyl-4-ethoxy-5-methoxy-N-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1,3-thiazol-2-yl]benzamide Openeye Name: 3-chloro-4-ethoxy-5-methoxy-N-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]thiazol-2-yl]benzamide CAS Name: 3-chloro-4-ethoxy-5-methoxy-N-[4-[[(3S)-3-methyl-1-piperidin-1-iumyl]methyl]-2-thiazolyl]benzamide IUPAC Name: 3-chloro-4-ethoxy-5-methoxy-N-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-1,3-thiazol-2-yl]benzamide Traditional Name: 3-chloro-4-ethoxy-5-methoxy-N-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]thiazol-2-yl]benzamide Formula: C20H27ClN3O3S+ MolecularWeight: 424.96468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C(=O)NC2=NC(=CS2)C[NH+]3CCCC(C3)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)C(=O)NC2=NC(=CS2)C[NH+]3CCC[C@@H](C3)C)OC

InChI

InChI=1S/C20H26ClN3O3S/c1-4-27-18-16(21)8-14(9-17(18)26-3)19(25)23-20-22-15(12-28-20)11-24-7-5-6-13(2)10-24/h8-9,12-13H,4-7,10-11H2,1-3H3,(H,22,23,25)/p+1/t13-/m0/s1