tert-butyl (3S,4S)-3-[(5-chloranylthiophen-2-yl)carbonylamino]-4-oxidanyl-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (3S,4S)-3-[(5-chloranylthiophen-2-yl)carbonylamino]-4-oxidanyl-pyrrolidine-1-carboxylate Openeye Name: tert-butyl (3S,4S)-3-[(5-chlorothiophene-2-carbonyl)amino]-4-hydroxy-pyrrolidine-1-carboxylate CAS Name: (3S,4S)-3-[[(5-chloro-2-thiophenyl)-oxomethyl]amino]-4-hydroxy-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3S,4S)-3-[(5-chlorothiophene-2-carbonyl)amino]-4-hydroxypyrrolidine-1-carboxylate Traditional Name: (3S,4S)-3-[(5-chlorothiophene-2-carbonyl)amino]-4-hydroxy-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C14H19ClN2O4S MolecularWeight: 346.82966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(C(C1)O)NC(=O)C2=CC=C(S2)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1C[C@@H]([C@H](C1)O)NC(=O)C2=CC=C(S2)Cl

InChI

InChI=1S/C14H19ClN2O4S/c1-14(2,3)21-13(20)17-6-8(9(18)7-17)16-12(19)10-4-5-11(15)22-10/h4-5,8-9,18H,6-7H2,1-3H3,(H,16,19)/t8-,9-/m0/s1