N-[(4-bromophenyl)carbamoyl]-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[(4-bromophenyl)carbamoyl]-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[(4-bromophenyl)carbamoyl]-2-(3-oxopiperazin-1-ium-1-yl)acetamide CAS Name: N-[(4-bromoanilino)-oxomethyl]-2-(3-oxo-1-piperazin-1-iumyl)acetamide IUPAC Name: N-[(4-bromophenyl)carbamoyl]-2-(3-oxopiperazin-1-ium-1-yl)acetamide Traditional Name: N-[(4-bromophenyl)carbamoyl]-2-(3-ketopiperazin-1-ium-1-yl)acetamide Formula: C13H16BrN4O3+ MolecularWeight: 356.19514

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC(=O)N1)CC(=O)NC(=O)NC2=CC=C(C=C2)Br

Isomeric SMILES

C1C[NH+](CC(=O)N1)CC(=O)NC(=O)NC2=CC=C(C=C2)Br

InChI

InChI=1S/C13H15BrN4O3/c14-9-1-3-10(4-2-9)16-13(21)17-12(20)8-18-6-5-15-11(19)7-18/h1-4H,5-8H2,(H,15,19)(H2,16,17,20,21)/p+1