1-[2-[(4-bromanyl-2-chloranyl-phenyl)amino]-2-oxidanylidene-ethyl]-N-(2-methoxyethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[(4-bromanyl-2-chloranyl-phenyl)amino]-2-oxidanylidene-ethyl]-N-(2-methoxyethyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-(4-bromo-2-chloro-anilino)-2-oxo-ethyl]-N-(2-methoxyethyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[2-(4-bromo-2-chloroanilino)-2-oxoethyl]-N-(2-methoxyethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-(4-bromo-2-chloroanilino)-2-oxoethyl]-N-(2-methoxyethyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-(4-bromo-2-chloro-anilino)-2-keto-ethyl]-N-(2-methoxyethyl)piperidin-1-ium-4-carboxamide Formula: C17H24BrClN3O3+ MolecularWeight: 433.74776

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C1CC[NH+](CC1)CC(=O)NC2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

COCCNC(=O)C1CC[NH+](CC1)CC(=O)NC2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C17H23BrClN3O3/c1-25-9-6-20-17(24)12-4-7-22(8-5-12)11-16(23)21-15-3-2-13(18)10-14(15)19/h2-3,10,12H,4-9,11H2,1H3,(H,20,24)(H,21,23)/p+1