tert-butyl N-[(3R)-1-methylsulfonyl-2-oxidanylidene-azepan-3-yl]carbamate

Systemtic Name: tert-butyl N-[(3R)-1-methylsulfonyl-2-oxidanylidene-azepan-3-yl]carbamate Openeye Name: tert-butyl N-[(3R)-1-methylsulfonyl-2-oxo-azepan-3-yl]carbamate CAS Name: N-[(3R)-1-methylsulfonyl-2-oxo-3-azepanyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3R)-1-methylsulfonyl-2-oxoazepan-3-yl]carbamate Traditional Name: N-[(3R)-2-keto-1-mesyl-azepan-3-yl]carbamic acid tert-butyl ester Formula: C12H22N2O5S MolecularWeight: 306.37848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCCCN(C1=O)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H]1CCCCN(C1=O)S(=O)(=O)C

InChI

InChI=1S/C12H22N2O5S/c1-12(2,3)19-11(16)13-9-7-5-6-8-14(10(9)15)20(4,17)18/h9H,5-8H2,1-4H3,(H,13,16)/t9-/m1/s1