(2R)-N-cyclohexyl-2-[4-[(3,4-dimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]propanamide

Systemtic Name: (2R)-N-cyclohexyl-2-[4-[(3,4-dimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]propanamide Openeye Name: (2R)-N-cyclohexyl-2-[4-[(3,4-dimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]propanamide CAS Name: (2R)-N-cyclohexyl-2-[4-[(3,4-dimethoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]propanamide IUPAC Name: (2R)-N-cyclohexyl-2-[4-[(3,4-dimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]propanamide Traditional Name: (2R)-N-cyclohexyl-2-(4-veratrylpiperazine-1,4-diium-1-yl)propionamide Formula: C22H37N3O3+2 MolecularWeight: 391.54748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCC1)[NH+]2CC[NH+](CC2)CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

C[C@H](C(=O)NC1CCCCC1)[NH+]2CC[NH+](CC2)CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H35N3O3/c1-17(22(26)23-19-7-5-4-6-8-19)25-13-11-24(12-14-25)16-18-9-10-20(27-2)21(15-18)28-3/h9-10,15,17,19H,4-8,11-14,16H2,1-3H3,(H,23,26)/p+2/t17-/m1/s1