2-[4-(dimethylaminomethylsulfanyl)morpholin-4-ium-4-yl]-1-phenyl-propan-1-one

Systemtic Name: 2-[4-(dimethylaminomethylsulfanyl)morpholin-4-ium-4-yl]-1-phenyl-propan-1-one Openeye Name: 2-[4-(dimethylaminomethylsulfanyl)morpholin-4-ium-4-yl]-1-phenyl-propan-1-one CAS Name: 2-[4-(dimethylaminomethylthio)-4-morpholin-4-iumyl]-1-phenyl-1-propanone IUPAC Name: 2-[4-(dimethylaminomethylsulfanyl)morpholin-4-ium-4-yl]-1-phenylpropan-1-one Traditional Name: 2-[4-(dimethylaminomethylthio)morpholin-4-ium-4-yl]-1-phenyl-propan-1-one Formula: C16H25N2O2S+ MolecularWeight: 309.4469

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=CC=C1)[N+]2(CCOCC2)SCN(C)C

Isomeric SMILES

CC(C(=O)C1=CC=CC=C1)[N+]2(CCOCC2)SCN(C)C

InChI

InChI=1S/C16H25N2O2S/c1-14(16(19)15-7-5-4-6-8-15)18(21-13-17(2)3)9-11-20-12-10-18/h4-8,14H,9-13H2,1-3H3/q+1