[4-[(2R)-3-(1-bromanylnaphthalen-2-yl)oxy-2-oxidanyl-propyl]piperazin-4-ium-1-yl]-phenyl-methanone

Systemtic Name: [4-[(2R)-3-(1-bromanylnaphthalen-2-yl)oxy-2-oxidanyl-propyl]piperazin-4-ium-1-yl]-phenyl-methanone Openeye Name: [4-[(2R)-3-[(1-bromo-2-naphthyl)oxy]-2-hydroxy-propyl]piperazin-4-ium-1-yl]-phenyl-methanone CAS Name: [4-[(2R)-3-[(1-bromo-2-naphthalenyl)oxy]-2-hydroxypropyl]-1-piperazin-4-iumyl]-phenylmethanone IUPAC Name: [4-[(2R)-3-(1-bromonaphthalen-2-yl)oxy-2-hydroxypropyl]piperazin-4-ium-1-yl]-phenylmethanone Traditional Name: [4-[(2R)-3-(1-bromo-2-naphthoxy)-2-hydroxy-propyl]piperazin-4-ium-1-yl]-phenyl-methanone Formula: C24H26BrN2O3+ MolecularWeight: 470.37884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(COC2=C(C3=CC=CC=C3C=C2)Br)O)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1C[C@H](COC2=C(C3=CC=CC=C3C=C2)Br)O)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H25BrN2O3/c25-23-21-9-5-4-6-18(21)10-11-22(23)30-17-20(28)16-26-12-14-27(15-13-26)24(29)19-7-2-1-3-8-19/h1-11,20,28H,12-17H2/p+1/t20-/m1/s1