(2R)-2-(2-chloranylphenoxy)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)propan-1-one

Systemtic Name: (2R)-2-(2-chloranylphenoxy)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)propan-1-one Openeye Name: (2R)-2-(2-chlorophenoxy)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)propan-1-one CAS Name: (2R)-2-(2-chlorophenoxy)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)-1-propanone IUPAC Name: (2R)-2-(2-chlorophenoxy)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)propan-1-one Traditional Name: (2R)-2-(2-chlorophenoxy)-1-(4-methyl-1,4-diazepan-4-ium-1-yl)propan-1-one Formula: C15H22ClN2O2+ MolecularWeight: 297.80038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC[NH+](CC1)C)OC2=CC=CC=C2Cl

Isomeric SMILES

C[C@H](C(=O)N1CCC[NH+](CC1)C)OC2=CC=CC=C2Cl

InChI

InChI=1S/C15H21ClN2O2/c1-12(20-14-7-4-3-6-13(14)16)15(19)18-9-5-8-17(2)10-11-18/h3-4,6-7,12H,5,8-11H2,1-2H3/p+1/t12-/m1/s1