tert-butyl N-[1,3-bis(oxidanyl)-5-(2-phenylmethoxyphenyl)heptan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1,3-bis(oxidanyl)-5-(2-phenylmethoxyphenyl)heptan-2-yl]carbamate Openeye Name: tert-butyl N-[4-(2-benzyloxyphenyl)-2-hydroxy-1-(hydroxymethyl)hexyl]carbamate CAS Name: N-[1,3-dihydroxy-5-(2-phenylmethoxyphenyl)heptan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1,3-dihydroxy-5-(2-phenylmethoxyphenyl)heptan-2-yl]carbamate Traditional Name: N-[4-(2-benzoxyphenyl)-2-hydroxy-1-methylol-hexyl]carbamic acid tert-butyl ester Formula: C25H35NO5 MolecularWeight: 429.5491

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C(CO)NC(=O)OC(C)(C)C)O)C1=CC=CC=C1OCC2=CC=CC=C2

Isomeric SMILES

CCC(CC(C(CO)NC(=O)OC(C)(C)C)O)C1=CC=CC=C1OCC2=CC=CC=C2

InChI

InChI=1S/C25H35NO5/c1-5-19(15-22(28)21(16-27)26-24(29)31-25(2,3)4)20-13-9-10-14-23(20)30-17-18-11-7-6-8-12-18/h6-14,19,21-22,27-28H,5,15-17H2,1-4H3,(H,26,29)