ethyl 2-[[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-4-methyl-pentanoate

Systemtic Name: ethyl 2-[[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-4-methyl-pentanoate Openeye Name: ethyl 2-[[1-adamantyloxy-[1-(benzyloxycarbonylamino)-2-phenyl-ethyl]phosphoryl]methyl]-4-methyl-pentanoate CAS Name: 2-[[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-4-methylpentanoic acid ethyl ester IUPAC Name: ethyl 2-[[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-4-methylpentanoate Traditional Name: 2-[[1-adamantyloxy-[1-(benzyloxycarbonylamino)-2-phenyl-ethyl]phosphoryl]methyl]-4-methyl-valeric acid ethyl ester Formula: C35H48NO6P MolecularWeight: 609.732481

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C)C)CP(=O)(C(CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2)OC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCOC(=O)C(CC(C)C)CP(=O)(C(CC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2)OC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C35H48NO6P/c1-4-40-33(37)31(15-25(2)3)24-43(39,42-35-20-28-16-29(21-35)18-30(17-28)22-35)32(19-26-11-7-5-8-12-26)36-34(38)41-23-27-13-9-6-10-14-27/h5-14,25,28-32H,4,15-24H2,1-3H3,(H,36,38)