ethyl 1-(2-bromophenyl)carbonyl-2-ethanoyl-piperidin-1-ium-1-carboxylate

Systemtic Name: ethyl 1-(2-bromophenyl)carbonyl-2-ethanoyl-piperidin-1-ium-1-carboxylate Openeye Name: ethyl 2-acetyl-1-(2-bromobenzoyl)piperidin-1-ium-1-carboxylate CAS Name: 2-acetyl-1-[(2-bromophenyl)-oxomethyl]-1-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 2-acetyl-1-(2-bromobenzoyl)piperidin-1-ium-1-carboxylate Traditional Name: 2-acetyl-1-(2-bromobenzoyl)piperidin-1-ium-1-carboxylic acid ethyl ester Formula: C17H21BrNO4+ MolecularWeight: 383.25694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)[N+]1(CCCCC1C(=O)C)C(=O)C2=CC=CC=C2Br

Isomeric SMILES

CCOC(=O)[N+]1(CCCCC1C(=O)C)C(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C17H21BrNO4/c1-3-23-17(22)19(11-7-6-10-15(19)12(2)20)16(21)13-8-4-5-9-14(13)18/h4-5,8-9,15H,3,6-7,10-11H2,1-2H3/q+1