4-oxidanylidene-N-[(2S)-2-oxidanylpropyl]-4-piperazin-4-ium-1-yl-butanamide

Systemtic Name: 4-oxidanylidene-N-[(2S)-2-oxidanylpropyl]-4-piperazin-4-ium-1-yl-butanamide Openeye Name: N-[(2S)-2-hydroxypropyl]-4-oxo-4-piperazin-4-ium-1-yl-butanamide CAS Name: N-[(2S)-2-hydroxypropyl]-4-oxo-4-(1-piperazin-4-iumyl)butanamide IUPAC Name: N-[(2S)-2-hydroxypropyl]-4-oxo-4-piperazin-4-ium-1-ylbutanamide Traditional Name: N-[(2S)-2-hydroxypropyl]-4-keto-4-piperazin-4-ium-1-yl-butyramide Formula: C11H22N3O3+ MolecularWeight: 244.31068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)CCC(=O)N1CC[NH2+]CC1)O

Isomeric SMILES

C[C@@H](CNC(=O)CCC(=O)N1CC[NH2+]CC1)O

InChI

InChI=1S/C11H21N3O3/c1-9(15)8-13-10(16)2-3-11(17)14-6-4-12-5-7-14/h9,12,15H,2-8H2,1H3,(H,13,16)/p+1/t9-/m0/s1