tert-butyl N-[(2S)-2-cyclohexyl-2-oxidanyl-ethyl]-N-(2-nitrophenyl)sulfonyl-carbamate

Systemtic Name: tert-butyl N-[(2S)-2-cyclohexyl-2-oxidanyl-ethyl]-N-(2-nitrophenyl)sulfonyl-carbamate Openeye Name: tert-butyl N-[(2S)-2-cyclohexyl-2-hydroxy-ethyl]-N-(2-nitrophenyl)sulfonyl-carbamate CAS Name: N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-N-(2-nitrophenyl)sulfonylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-N-(2-nitrophenyl)sulfonylcarbamate Traditional Name: N-[(2S)-2-cyclohexyl-2-hydroxy-ethyl]-N-(2-nitrophenyl)sulfonyl-carbamic acid tert-butyl ester Formula: C19H28N2O7S MolecularWeight: 428.49982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC(C1CCCCC1)O)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N(C[C@H](C1CCCCC1)O)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C19H28N2O7S/c1-19(2,3)28-18(23)20(13-16(22)14-9-5-4-6-10-14)29(26,27)17-12-8-7-11-15(17)21(24)25/h7-8,11-12,14,16,22H,4-6,9-10,13H2,1-3H3/t16-/m1/s1