2-[[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-6-phenyl-hexanoic acid

Systemtic Name: 2-[[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-6-phenyl-hexanoic acid Openeye Name: 2-[[1-adamantyloxy-[1-(benzyloxycarbonylamino)-2-phenyl-ethyl]phosphoryl]methyl]-6-phenyl-hexanoic acid CAS Name: 2-[[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-6-phenylhexanoic acid IUPAC Name: 2-[[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-6-phenylhexanoic acid Traditional Name: 2-[[1-adamantyloxy-[1-(benzyloxycarbonylamino)-2-phenyl-ethyl]phosphoryl]methyl]-6-phenyl-hexanoic acid Formula: C39H48NO6P MolecularWeight: 657.775281

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)OP(=O)(CC(CCCCC4=CC=CC=C4)C(=O)O)C(CC5=CC=CC=C5)NC(=O)OCC6=CC=CC=C6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)OP(=O)(CC(CCCCC4=CC=CC=C4)C(=O)O)C(CC5=CC=CC=C5)NC(=O)OCC6=CC=CC=C6

InChI

InChI=1S/C39H48NO6P/c41-37(42)35(19-11-10-14-29-12-4-1-5-13-29)28-47(44,46-39-24-32-20-33(25-39)22-34(21-32)26-39)36(23-30-15-6-2-7-16-30)40-38(43)45-27-31-17-8-3-9-18-31/h1-9,12-13,15-18,32-36H,10-11,14,19-28H2,(H,40,43)(H,41,42)