(2S)-N-[2,6-bis(bromanyl)-4-methyl-phenyl]-2-morpholin-4-ium-4-yl-propanamide

Systemtic Name: (2S)-N-[2,6-bis(bromanyl)-4-methyl-phenyl]-2-morpholin-4-ium-4-yl-propanamide Openeye Name: (2S)-N-(2,6-dibromo-4-methyl-phenyl)-2-morpholin-4-ium-4-yl-propanamide CAS Name: (2S)-N-(2,6-dibromo-4-methylphenyl)-2-(4-morpholin-4-iumyl)propanamide IUPAC Name: (2S)-N-(2,6-dibromo-4-methylphenyl)-2-morpholin-4-ium-4-ylpropanamide Traditional Name: (2S)-N-(2,6-dibromo-4-methyl-phenyl)-2-morpholin-4-ium-4-yl-propionamide Formula: C14H19Br2N2O2+ MolecularWeight: 407.12086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)NC(=O)C(C)[NH+]2CCOCC2)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)NC(=O)[C@H](C)[NH+]2CCOCC2)Br

InChI

InChI=1S/C14H18Br2N2O2/c1-9-7-11(15)13(12(16)8-9)17-14(19)10(2)18-3-5-20-6-4-18/h7-8,10H,3-6H2,1-2H3,(H,17,19)/p+1/t10-/m0/s1