2-methyl-2-[oxidanyl(4-phenylbutyl)phosphoryl]oxy-6-(phenylmethoxycarbonylamino)hexanoate

Systemtic Name: 2-methyl-2-[oxidanyl(4-phenylbutyl)phosphoryl]oxy-6-(phenylmethoxycarbonylamino)hexanoate Openeye Name: 6-(benzyloxycarbonylamino)-2-[hydroxy(4-phenylbutyl)phosphoryl]oxy-2-methyl-hexanoate CAS Name: 2-[hydroxy(4-phenylbutyl)phosphoryl]oxy-2-methyl-6-(phenylmethoxycarbonylamino)hexanoate IUPAC Name: 2-[hydroxy(4-phenylbutyl)phosphoryl]oxy-2-methyl-6-(phenylmethoxycarbonylamino)hexanoate Traditional Name: 6-(benzyloxycarbonylamino)-2-[hydroxy(4-phenylbutyl)phosphoryl]oxy-2-methyl-hexanoate Formula: C25H33NO7P- MolecularWeight: 490.505781

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCNC(=O)OCC1=CC=CC=C1)(C(=O)[O-])OP(=O)(CCCCC2=CC=CC=C2)O

Isomeric SMILES

CC(CCCCNC(=O)OCC1=CC=CC=C1)(C(=O)[O-])OP(=O)(CCCCC2=CC=CC=C2)O

InChI

InChI=1S/C25H34NO7P/c1-25(23(27)28,33-34(30,31)19-11-8-14-21-12-4-2-5-13-21)17-9-10-18-26-24(29)32-20-22-15-6-3-7-16-22/h2-7,12-13,15-16H,8-11,14,17-20H2,1H3,(H,26,29)(H,27,28)(H,30,31)/p-1