3-(azepan-1-ium-1-yl)-N-phenyl-propanamide

Systemtic Name: 3-(azepan-1-ium-1-yl)-N-phenyl-propanamide Openeye Name: 3-(azepan-1-ium-1-yl)-N-phenyl-propanamide CAS Name: 3-(1-azepan-1-iumyl)-N-phenylpropanamide IUPAC Name: 3-(azepan-1-ium-1-yl)-N-phenylpropanamide Traditional Name: 3-(azepan-1-ium-1-yl)-N-phenyl-propionamide Formula: C15H23N2O+ MolecularWeight: 247.35592

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CCC(=O)NC2=CC=CC=C2

Isomeric SMILES

C1CCC[NH+](CC1)CCC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C15H22N2O/c18-15(16-14-8-4-3-5-9-14)10-13-17-11-6-1-2-7-12-17/h3-5,8-9H,1-2,6-7,10-13H2,(H,16,18)/p+1