tert-butyl N-[1,1,1-tris(oxidanyl)-3-phenylmethoxy-octadecan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1,1,1-tris(oxidanyl)-3-phenylmethoxy-octadecan-2-yl]carbamate Openeye Name: tert-butyl N-[2-benzyloxy-1-(trihydroxymethyl)heptadecyl]carbamate CAS Name: N-(1,1,1-trihydroxy-3-phenylmethoxyoctadecan-2-yl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(1,1,1-trihydroxy-3-phenylmethoxyoctadecan-2-yl)carbamate Traditional Name: N-[2-benzoxy-1-(trihydroxymethyl)heptadecyl]carbamic acid tert-butyl ester Formula: C30H53NO6 MolecularWeight: 523.74492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(C(C(O)(O)O)NC(=O)OC(C)(C)C)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCC(C(C(O)(O)O)NC(=O)OC(C)(C)C)OCC1=CC=CC=C1

InChI

InChI=1S/C30H53NO6/c1-5-6-7-8-9-10-11-12-13-14-15-16-20-23-26(36-24-25-21-18-17-19-22-25)27(30(33,34)35)31-28(32)37-29(2,3)4/h17-19,21-22,26-27,33-35H,5-16,20,23-24H2,1-4H3,(H,31,32)