3-(azepan-1-ium-1-yl)-1-phenyl-propan-1-one

Systemtic Name: 3-(azepan-1-ium-1-yl)-1-phenyl-propan-1-one Openeye Name: 3-(azepan-1-ium-1-yl)-1-phenyl-propan-1-one CAS Name: 3-(1-azepan-1-iumyl)-1-phenyl-1-propanone IUPAC Name: 3-(azepan-1-ium-1-yl)-1-phenylpropan-1-one Traditional Name: 3-(azepan-1-ium-1-yl)-1-phenyl-propan-1-one Formula: C15H22NO+ MolecularWeight: 232.34128

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CCC(=O)C2=CC=CC=C2

Isomeric SMILES

C1CCC[NH+](CC1)CCC(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H21NO/c17-15(14-8-4-3-5-9-14)10-13-16-11-6-1-2-7-12-16/h3-5,8-9H,1-2,6-7,10-13H2/p+1