(2S)-3-(4-methanoylpiperazin-1-yl)sulfonyl-2-methyl-propanoic acid

Systemtic Name: (2S)-3-(4-methanoylpiperazin-1-yl)sulfonyl-2-methyl-propanoic acid Openeye Name: (2S)-3-(4-formylpiperazin-1-yl)sulfonyl-2-methyl-propanoic acid CAS Name: (2S)-3-[(4-formyl-1-piperazinyl)sulfonyl]-2-methylpropanoic acid IUPAC Name: (2S)-3-(4-formylpiperazin-1-yl)sulfonyl-2-methylpropanoic acid Traditional Name: (2S)-3-(4-formylpiperazino)sulfonyl-2-methyl-propionic acid Formula: C9H16N2O5S MolecularWeight: 264.29874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CS(=O)(=O)N1CCN(CC1)C=O)C(=O)O

Isomeric SMILES

C[C@H](CS(=O)(=O)N1CCN(CC1)C=O)C(=O)O

InChI

InChI=1S/C9H16N2O5S/c1-8(9(13)14)6-17(15,16)11-4-2-10(7-12)3-5-11/h7-8H,2-6H2,1H3,(H,13,14)/t8-/m1/s1