(2S)-2-azanyl-4-hexylsulfanyl-pentanedioic acid

Systemtic Name: (2S)-2-azanyl-4-hexylsulfanyl-pentanedioic acid Openeye Name: (2S)-2-amino-4-hexylsulfanyl-pentanedioic acid CAS Name: (2S)-2-amino-4-(hexylthio)pentanedioic acid IUPAC Name: (2S)-2-amino-4-hexylsulfanylpentanedioic acid Traditional Name: (2S)-2-amino-4-(hexylthio)glutaric acid Formula: C11H21NO4S MolecularWeight: 263.35374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC(CC(C(=O)O)N)C(=O)O

Isomeric SMILES

CCCCCCSC(C[C@@H](C(=O)O)N)C(=O)O

InChI

InChI=1S/C11H21NO4S/c1-2-3-4-5-6-17-9(11(15)16)7-8(12)10(13)14/h8-9H,2-7,12H2,1H3,(H,13,14)(H,15,16)/t8-,9?/m0/s1