N-butyl-N-methyl-2-[(2R)-1-(naphthalen-1-ylmethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]ethanamide

Systemtic Name: N-butyl-N-methyl-2-[(2R)-1-(naphthalen-1-ylmethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]ethanamide Openeye Name: N-butyl-N-methyl-2-[(2R)-1-(1-naphthylmethyl)-3-oxo-piperazin-1-ium-2-yl]acetamide CAS Name: N-butyl-N-methyl-2-[(2R)-1-(1-naphthalenylmethyl)-3-oxo-2-piperazin-1-iumyl]acetamide IUPAC Name: N-butyl-N-methyl-2-[(2R)-1-(naphthalen-1-ylmethyl)-3-oxopiperazin-1-ium-2-yl]acetamide Traditional Name: N-butyl-2-[(2R)-3-keto-1-(1-naphthylmethyl)piperazin-1-ium-2-yl]-N-methyl-acetamide Formula: C22H30N3O2+ MolecularWeight: 368.4925

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)CC1C(=O)NCC[NH+]1CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CCCCN(C)C(=O)C[C@@H]1C(=O)NCC[NH+]1CC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C22H29N3O2/c1-3-4-13-24(2)21(26)15-20-22(27)23-12-14-25(20)16-18-10-7-9-17-8-5-6-11-19(17)18/h5-11,20H,3-4,12-16H2,1-2H3,(H,23,27)/p+1/t20-/m1/s1