2-[[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-4-naphthalen-2-yl-butanoic acid

Systemtic Name: 2-[[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-4-naphthalen-2-yl-butanoic acid Openeye Name: 2-[[1-adamantyloxy-[1-(benzyloxycarbonylamino)-2-phenyl-ethyl]phosphoryl]methyl]-4-(2-naphthyl)butanoic acid CAS Name: 2-[[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-4-(2-naphthalenyl)butanoic acid IUPAC Name: 2-[[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-4-naphthalen-2-ylbutanoic acid Traditional Name: 2-[[1-adamantyloxy-[1-(benzyloxycarbonylamino)-2-phenyl-ethyl]phosphoryl]methyl]-4-(2-naphthyl)butyric acid Formula: C41H46NO6P MolecularWeight: 679.780801

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)OP(=O)(CC(CCC4=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(CCC4=CC5=CC=CC=C5C=C4)C(=O)O)C(CC6=CC=CC=C6)NC(=O)OCC7=CC=CC=C7

InChI

InChI=1S/C41H46NO6P/c43-39(44)37(18-16-30-15-17-35-13-7-8-14-36(35)22-30)28-49(46,48-41-24-32-19-33(25-41)21-34(20-32)26-41)38(23-29-9-3-1-4-10-29)42-40(45)47-27-31-11-5-2-6-12-31/h1-15,17,22,32-34,37-38H,16,18-21,23-28H2,(H,42,45)(H,43,44)