2,2-dimethyl-N-(phenylmethyl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide

Systemtic Name: 2,2-dimethyl-N-(phenylmethyl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide Openeye Name: N-benzyl-2,2-dimethyl-3-piperazin-4-ium-1-ylsulfonyl-propanamide CAS Name: 2,2-dimethyl-N-(phenylmethyl)-3-(1-piperazin-4-iumylsulfonyl)propanamide IUPAC Name: N-benzyl-2,2-dimethyl-3-piperazin-4-ium-1-ylsulfonylpropanamide Traditional Name: N-benzyl-2,2-dimethyl-3-piperazin-4-ium-1-ylsulfonyl-propionamide Formula: C16H26N3O3S+ MolecularWeight: 340.46094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CS(=O)(=O)N1CC[NH2+]CC1)C(=O)NCC2=CC=CC=C2

Isomeric SMILES

CC(C)(CS(=O)(=O)N1CC[NH2+]CC1)C(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C16H25N3O3S/c1-16(2,13-23(21,22)19-10-8-17-9-11-19)15(20)18-12-14-6-4-3-5-7-14/h3-7,17H,8-13H2,1-2H3,(H,18,20)/p+1