tert-butyl N-butylsulfonyl-N-(2-phenylmethoxyphenyl)carbamate; ethanoic acid

Systemtic Name: tert-butyl N-butylsulfonyl-N-(2-phenylmethoxyphenyl)carbamate; ethanoic acid Openeye Name: acetic acid; tert-butyl N-(2-benzyloxyphenyl)-N-butylsulfonyl-carbamate CAS Name: acetic acid; N-butylsulfonyl-N-(2-phenylmethoxyphenyl)carbamic acid tert-butyl ester IUPAC Name: acetic acid; tert-butyl N-butylsulfonyl-N-(2-phenylmethoxyphenyl)carbamate Traditional Name: acetic acid; N-(2-benzoxyphenyl)-N-butylsulfonyl-carbamic acid tert-butyl ester Formula: C24H33NO7S MolecularWeight: 479.58632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N(C1=CC=CC=C1OCC2=CC=CC=C2)C(=O)OC(C)(C)C.CC(=O)O

Isomeric SMILES

CCCCS(=O)(=O)N(C1=CC=CC=C1OCC2=CC=CC=C2)C(=O)OC(C)(C)C.CC(=O)O

InChI

InChI=1S/C22H29NO5S.C2H4O2/c1-5-6-16-29(25,26)23(21(24)28-22(2,3)4)19-14-10-11-15-20(19)27-17-18-12-8-7-9-13-18;1-2(3)4/h7-15H,5-6,16-17H2,1-4H3;1H3,(H,3,4)