2,2,2-tris(chloranyl)-N-[4-oxidanylidene-3-(piperidin-1-ium-1-ylmethyl)chromen-2-yl]ethanamide

Systemtic Name: 2,2,2-tris(chloranyl)-N-[4-oxidanylidene-3-(piperidin-1-ium-1-ylmethyl)chromen-2-yl]ethanamide Openeye Name: 2,2,2-trichloro-N-[4-oxo-3-(piperidin-1-ium-1-ylmethyl)chromen-2-yl]acetamide CAS Name: 2,2,2-trichloro-N-[4-oxo-3-(1-piperidin-1-iumylmethyl)-1-benzopyran-2-yl]acetamide IUPAC Name: 2,2,2-trichloro-N-[4-oxo-3-(piperidin-1-ium-1-ylmethyl)chromen-2-yl]acetamide Traditional Name: 2,2,2-trichloro-N-[4-keto-3-(piperidin-1-ium-1-ylmethyl)chromen-2-yl]acetamide Formula: C17H18Cl3N2O3+ MolecularWeight: 404.69542

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=C(OC3=CC=CC=C3C2=O)NC(=O)C(Cl)(Cl)Cl

Isomeric SMILES

C1CC[NH+](CC1)CC2=C(OC3=CC=CC=C3C2=O)NC(=O)C(Cl)(Cl)Cl

InChI

InChI=1S/C17H17Cl3N2O3/c18-17(19,20)16(24)21-15-12(10-22-8-4-1-5-9-22)14(23)11-6-2-3-7-13(11)25-15/h2-3,6-7H,1,4-5,8-10H2,(H,21,24)/p+1