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

Systemtic Name: methyl 5-[(2R,3S,4R)-3-chloranyl-4-(methoxycarbonylamino)thiolan-2-yl]pentanoate Openeye Name: methyl 5-[(2R,3S,4R)-3-chloro-4-(methoxycarbonylamino)tetrahydrothiophen-2-yl]pentanoate CAS Name: 5-[(2R,3S,4R)-3-chloro-4-(methoxycarbonylamino)-2-thiolanyl]pentanoic acid methyl ester IUPAC Name: methyl 5-[(2R,3S,4R)-3-chloro-4-(methoxycarbonylamino)thiolan-2-yl]pentanoate Traditional Name: 5-[(2R,3S,4R)-4-(carbomethoxyamino)-3-chloro-tetrahydrothiophen-2-yl]valeric acid methyl ester Formula: C12H20ClNO4S MolecularWeight: 309.8095

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H20ClNO4S/c1-17-10(15)6-4-3-5-9-11(13)8(7-19-9)14-12(16)18-2/h8-9,11H,3-7H2,1-2H3,(H,14,16)/t8-,9-,11+/m1/s1