(2R)-3-(1-methylazepan-1-ium-1-yl)-1,2-diphenyl-propan-1-one

Systemtic Name: (2R)-3-(1-methylazepan-1-ium-1-yl)-1,2-diphenyl-propan-1-one Openeye Name: (2R)-3-(1-methylazepan-1-ium-1-yl)-1,2-diphenyl-propan-1-one CAS Name: (2R)-3-(1-methyl-1-azepan-1-iumyl)-1,2-diphenyl-1-propanone IUPAC Name: (2R)-3-(1-methylazepan-1-ium-1-yl)-1,2-diphenylpropan-1-one Traditional Name: (2R)-3-(1-methylazepan-1-ium-1-yl)-1,2-diphenyl-propan-1-one Formula: C22H28NO+ MolecularWeight: 322.46382

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCCC1)CC(C2=CC=CC=C2)C(=O)C3=CC=CC=C3

Isomeric SMILES

C[N+]1(CCCCCC1)C[C@@H](C2=CC=CC=C2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H28NO/c1-23(16-10-2-3-11-17-23)18-21(19-12-6-4-7-13-19)22(24)20-14-8-5-9-15-20/h4-9,12-15,21H,2-3,10-11,16-18H2,1H3/q+1/t21-/m0/s1