methyl 5-[(2R,3S,4S)-4-(methoxycarbonylamino)-3-oxidanyl-thiolan-2-yl]pentanoate

Systemtic Name: methyl 5-[(2R,3S,4S)-4-(methoxycarbonylamino)-3-oxidanyl-thiolan-2-yl]pentanoate Openeye Name: methyl 5-[(2R,3S,4S)-3-hydroxy-4-(methoxycarbonylamino)tetrahydrothiophen-2-yl]pentanoate CAS Name: 5-[(2R,3S,4S)-3-hydroxy-4-(methoxycarbonylamino)-2-thiolanyl]pentanoic acid methyl ester IUPAC Name: methyl 5-[(2R,3S,4S)-3-hydroxy-4-(methoxycarbonylamino)thiolan-2-yl]pentanoate Traditional Name: 5-[(2R,3S,4S)-4-(carbomethoxyamino)-3-hydroxy-tetrahydrothiophen-2-yl]valeric acid methyl ester Formula: C12H21NO5S MolecularWeight: 291.36384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCC1C(C(CS1)NC(=O)OC)O

Isomeric SMILES

COC(=O)CCCC[C@@H]1[C@H]([C@@H](CS1)NC(=O)OC)O

InChI

InChI=1S/C12H21NO5S/c1-17-10(14)6-4-3-5-9-11(15)8(7-19-9)13-12(16)18-2/h8-9,11,15H,3-7H2,1-2H3,(H,13,16)/t8-,9-,11+/m1/s1