(2S)-2-(4-bromanylphenoxy)-N-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]propanamide

Systemtic Name: (2S)-2-(4-bromanylphenoxy)-N-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]propanamide Openeye Name: (2S)-2-(4-bromophenoxy)-N-[(2-morpholinopyridin-1-ium-3-yl)methyl]propanamide CAS Name: (2S)-2-(4-bromophenoxy)-N-[[2-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]propanamide IUPAC Name: (2S)-2-(4-bromophenoxy)-N-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]propanamide Traditional Name: (2S)-2-(4-bromophenoxy)-N-[(2-morpholinopyridin-1-ium-3-yl)methyl]propionamide Formula: C19H23BrN3O3+ MolecularWeight: 421.30822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=C([NH+]=CC=C1)N2CCOCC2)OC3=CC=C(C=C3)Br

Isomeric SMILES

C[C@@H](C(=O)NCC1=C([NH+]=CC=C1)N2CCOCC2)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H22BrN3O3/c1-14(26-17-6-4-16(20)5-7-17)19(24)22-13-15-3-2-8-21-18(15)23-9-11-25-12-10-23/h2-8,14H,9-13H2,1H3,(H,22,24)/p+1/t14-/m0/s1