4-bromanyl-N-[2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 4-bromanyl-N-[2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-2-oxidanylidene-ethyl]benzamide Openeye Name: 4-bromo-N-[2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-2-oxo-ethyl]benzamide CAS Name: 4-bromo-N-[2-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propylamino]-2-oxoethyl]benzamide IUPAC Name: 4-bromo-N-[2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]-2-oxoethyl]benzamide Traditional Name: 4-bromo-N-[2-keto-2-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propylamino]ethyl]benzamide Formula: C18H27BrN3O2+ MolecularWeight: 397.32988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC(=O)CNC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNC(=O)CNC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C18H26BrN3O2/c1-14-5-2-3-11-22(14)12-4-10-20-17(23)13-21-18(24)15-6-8-16(19)9-7-15/h6-9,14H,2-5,10-13H2,1H3,(H,20,23)(H,21,24)/p+1/t14-/m0/s1