tert-butyl N-[4-(2-ethyl-2-methanoyl-hexyl)sulfonyl-3-(phenylmethyl)phenyl]-N-oxidanyl-carbamate

Systemtic Name: tert-butyl N-[4-(2-ethyl-2-methanoyl-hexyl)sulfonyl-3-(phenylmethyl)phenyl]-N-oxidanyl-carbamate Openeye Name: tert-butyl N-[3-benzyl-4-(2-ethyl-2-formyl-hexyl)sulfonyl-phenyl]-N-hydroxy-carbamate CAS Name: N-[4-(2-ethyl-2-formylhexyl)sulfonyl-3-(phenylmethyl)phenyl]-N-hydroxycarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-benzyl-4-(2-ethyl-2-formylhexyl)sulfonylphenyl]-N-hydroxycarbamate Traditional Name: N-[3-benzyl-4-(2-ethyl-2-formyl-hexyl)sulfonyl-phenyl]-N-hydroxy-carbamic acid tert-butyl ester Formula: C27H37NO6S MolecularWeight: 503.65078

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)(CS(=O)(=O)C1=C(C=C(C=C1)N(C(=O)OC(C)(C)C)O)CC2=CC=CC=C2)C=O

Isomeric SMILES

CCCCC(CC)(CS(=O)(=O)C1=C(C=C(C=C1)N(C(=O)OC(C)(C)C)O)CC2=CC=CC=C2)C=O

InChI

InChI=1S/C27H37NO6S/c1-6-8-16-27(7-2,19-29)20-35(32,33)24-15-14-23(28(31)25(30)34-26(3,4)5)18-22(24)17-21-12-10-9-11-13-21/h9-15,18-19,31H,6-8,16-17,20H2,1-5H3