2-[4-[(3R)-1-(2-bromophenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylpiperazin-1-ium-1-yl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-[(3R)-1-(2-bromophenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylpiperazin-1-ium-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-[(3R)-1-(2-bromophenyl)-5-oxo-pyrrolidine-3-carbonyl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[[(3R)-1-(2-bromophenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]-1-piperazin-1-iumyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-[(3R)-1-(2-bromophenyl)-5-oxopyrrolidine-3-carbonyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-benzyl-2-[4-[(3R)-1-(2-bromophenyl)-5-keto-pyrrolidine-3-carbonyl]piperazin-1-ium-1-yl]acetamide Formula: C24H28BrN4O3+ MolecularWeight: 500.40812

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NCC2=CC=CC=C2)C(=O)C3CC(=O)N(C3)C4=CC=CC=C4Br

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NCC2=CC=CC=C2)C(=O)[C@@H]3CC(=O)N(C3)C4=CC=CC=C4Br

InChI

InChI=1S/C24H27BrN4O3/c25-20-8-4-5-9-21(20)29-16-19(14-23(29)31)24(32)28-12-10-27(11-13-28)17-22(30)26-15-18-6-2-1-3-7-18/h1-9,19H,10-17H2,(H,26,30)/p+1/t19-/m1/s1