2-[[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-5-phenyl-pentanoic acid

Systemtic Name: 2-[[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-5-phenyl-pentanoic acid Openeye Name: 2-[[1-adamantyloxy-[1-(benzyloxycarbonylamino)-2-phenyl-ethyl]phosphoryl]methyl]-5-phenyl-pentanoic acid CAS Name: 2-[[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-5-phenylpentanoic acid IUPAC Name: 2-[[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-5-phenylpentanoic acid Traditional Name: 2-[[1-adamantyloxy-[1-(benzyloxycarbonylamino)-2-phenyl-ethyl]phosphoryl]methyl]-5-phenyl-valeric acid Formula: C38H46NO6P MolecularWeight: 643.748701

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)OP(=O)(CC(CCCC4=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(CCCC4=CC=CC=C4)C(=O)O)C(CC5=CC=CC=C5)NC(=O)OCC6=CC=CC=C6

InChI

InChI=1S/C38H46NO6P/c40-36(41)34(18-10-17-28-11-4-1-5-12-28)27-46(43,45-38-23-31-19-32(24-38)21-33(20-31)25-38)35(22-29-13-6-2-7-14-29)39-37(42)44-26-30-15-8-3-9-16-30/h1-9,11-16,31-35H,10,17-27H2,(H,39,42)(H,40,41)