(2R)-N-cycloheptyl-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-N-cycloheptyl-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-N-cycloheptyl-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]propanamide CAS Name: (2R)-N-cycloheptyl-2-[4-(2-ethoxyphenyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-cycloheptyl-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-cycloheptyl-2-(4-o-phenetylpiperazin-1-ium-1-yl)propionamide Formula: C22H36N3O2+ MolecularWeight: 374.54014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC[NH+](CC2)C(C)C(=O)NC3CCCCCC3

Isomeric SMILES

CCOC1=CC=CC=C1N2CC[NH+](CC2)[C@H](C)C(=O)NC3CCCCCC3

InChI

InChI=1S/C22H35N3O2/c1-3-27-21-13-9-8-12-20(21)25-16-14-24(15-17-25)18(2)22(26)23-19-10-6-4-5-7-11-19/h8-9,12-13,18-19H,3-7,10-11,14-17H2,1-2H3,(H,23,26)/p+1/t18-/m1/s1