2-[[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-3-naphthalen-2-yl-propanoic acid

Systemtic Name: 2-[[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-3-naphthalen-2-yl-propanoic acid Openeye Name: 2-[[1-adamantyloxy-[1-(benzyloxycarbonylamino)-2-phenyl-ethyl]phosphoryl]methyl]-3-(2-naphthyl)propanoic acid CAS Name: 2-[[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-3-(2-naphthalenyl)propanoic acid IUPAC Name: 2-[[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-3-naphthalen-2-ylpropanoic acid Traditional Name: 2-[[1-adamantyloxy-[1-(benzyloxycarbonylamino)-2-phenyl-ethyl]phosphoryl]methyl]-3-(2-naphthyl)propionic acid Formula: C40H44NO6P MolecularWeight: 665.754221

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)OP(=O)(CC(CC4=CC5=CC=CC=C5C=C4)C(=O)O)C(CC6=CC=CC=C6)NC(=O)OCC7=CC=CC=C7

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)OP(=O)(CC(CC4=CC5=CC=CC=C5C=C4)C(=O)O)C(CC6=CC=CC=C6)NC(=O)OCC7=CC=CC=C7

InChI

InChI=1S/C40H44NO6P/c42-38(43)36(21-30-15-16-34-13-7-8-14-35(34)20-30)27-48(45,47-40-23-31-17-32(24-40)19-33(18-31)25-40)37(22-28-9-3-1-4-10-28)41-39(44)46-26-29-11-5-2-6-12-29/h1-16,20,31-33,36-37H,17-19,21-27H2,(H,41,44)(H,42,43)