methyl 3-azanyl-4-oxidanylidene-6-sulfanyl-hexanoate

Systemtic Name: methyl 3-azanyl-4-oxidanylidene-6-sulfanyl-hexanoate Openeye Name: methyl 3-amino-4-oxo-6-sulfanyl-hexanoate CAS Name: 3-amino-6-mercapto-4-oxohexanoic acid methyl ester IUPAC Name: methyl 3-amino-4-oxo-6-sulfanylhexanoate Traditional Name: 3-amino-4-keto-6-mercapto-hexanoic acid methyl ester Formula: C7H13NO3S MolecularWeight: 191.24802

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C(=O)CCS)N

Isomeric SMILES

COC(=O)CC(C(=O)CCS)N

InChI

InChI=1S/C7H13NO3S/c1-11-7(10)4-5(8)6(9)2-3-12/h5,12H,2-4,8H2,1H3