N-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[2-(2-bromoanilino)-2-oxo-ethyl]-N-methyl-2-(3-oxopiperazin-1-ium-1-yl)acetamide CAS Name: N-[2-(2-bromoanilino)-2-oxoethyl]-N-methyl-2-(3-oxo-1-piperazin-1-iumyl)acetamide IUPAC Name: N-[2-(2-bromoanilino)-2-oxoethyl]-N-methyl-2-(3-oxopiperazin-1-ium-1-yl)acetamide Traditional Name: N-[2-(2-bromoanilino)-2-keto-ethyl]-2-(3-ketopiperazin-1-ium-1-yl)-N-methyl-acetamide Formula: C15H20BrN4O3+ MolecularWeight: 384.2483

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC=C1Br)C(=O)C[NH+]2CCNC(=O)C2

Isomeric SMILES

CN(CC(=O)NC1=CC=CC=C1Br)C(=O)C[NH+]2CCNC(=O)C2

InChI

InChI=1S/C15H19BrN4O3/c1-19(15(23)10-20-7-6-17-13(21)9-20)8-14(22)18-12-5-3-2-4-11(12)16/h2-5H,6-10H2,1H3,(H,17,21)(H,18,22)/p+1