5-[(2S,3R,4R)-3,4-bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid

Systemtic Name: 5-[(2S,3R,4R)-3,4-bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid Openeye Name: 5-[(2S,3R,4R)-3,4-bis(methoxycarbonylamino)tetrahydrothiophen-2-yl]pentanoic acid CAS Name: 5-[(2S,3R,4R)-3,4-bis(methoxycarbonylamino)-2-thiolanyl]pentanoic acid IUPAC Name: 5-[(2S,3R,4R)-3,4-bis(methoxycarbonylamino)thiolan-2-yl]pentanoic acid Traditional Name: 5-[(2S,3R,4R)-3,4-bis(carbomethoxyamino)tetrahydrothiophen-2-yl]valeric acid Formula: C13H22N2O6S MolecularWeight: 334.38858

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1CSC(C1NC(=O)OC)CCCCC(=O)O

Isomeric SMILES

COC(=O)N[C@H]1CS[C@H]([C@@H]1NC(=O)OC)CCCCC(=O)O

InChI

InChI=1S/C13H22N2O6S/c1-20-12(18)14-8-7-22-9(5-3-4-6-10(16)17)11(8)15-13(19)21-2/h8-9,11H,3-7H2,1-2H3,(H,14,18)(H,15,19)(H,16,17)/t8-,9-,11+/m0/s1