4-bromanyl-N-[3-oxidanylidene-3-[[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]amino]propyl]benzamide

Systemtic Name: 4-bromanyl-N-[3-oxidanylidene-3-[[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]amino]propyl]benzamide Openeye Name: 4-bromo-N-[3-oxo-3-[[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]amino]propyl]benzamide CAS Name: 4-bromo-N-[3-oxo-3-[[(2R)-2-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]amino]propyl]benzamide IUPAC Name: 4-bromo-N-[3-oxo-3-[[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-ylethyl]amino]propyl]benzamide Traditional Name: 4-bromo-N-[3-keto-3-[[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]amino]propyl]benzamide Formula: C22H27BrN3O2+ MolecularWeight: 445.37268

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=O)CCNC(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CNC(=O)CCNC(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C22H26BrN3O2/c23-19-10-8-18(9-11-19)22(28)24-13-12-21(27)25-16-20(26-14-4-5-15-26)17-6-2-1-3-7-17/h1-3,6-11,20H,4-5,12-16H2,(H,24,28)(H,25,27)/p+1/t20-/m0/s1