2-[2-oxidanylidene-10-(sulfanylmethyl)azecan-3-yl]ethanoic acid

Systemtic Name: 2-[2-oxidanylidene-10-(sulfanylmethyl)azecan-3-yl]ethanoic acid Openeye Name: 2-[2-oxo-10-(sulfanylmethyl)azecan-3-yl]acetic acid CAS Name: 2-[10-(mercaptomethyl)-2-oxo-3-azecanyl]acetic acid IUPAC Name: 2-[2-oxo-10-(sulfanylmethyl)azecan-3-yl]acetic acid Traditional Name: 2-[2-keto-10-(mercaptomethyl)azecan-3-yl]acetic acid Formula: C12H21NO3S MolecularWeight: 259.36504

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(NC(=O)C(CC1)CC(=O)O)CS

Isomeric SMILES

C1CCCC(NC(=O)C(CC1)CC(=O)O)CS

InChI

InChI=1S/C12H21NO3S/c14-11(15)7-9-5-3-1-2-4-6-10(8-17)13-12(9)16/h9-10,17H,1-8H2,(H,13,16)(H,14,15)