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

Systemtic Name: ethyl 2-[[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-6-phenyl-hexanoate Openeye Name: ethyl 2-[[1-adamantyloxy-[1-(benzyloxycarbonylamino)-2-phenyl-ethyl]phosphoryl]methyl]-6-phenyl-hexanoate CAS Name: 2-[[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-6-phenylhexanoic acid ethyl ester IUPAC Name: ethyl 2-[[1-adamantyloxy-[2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-6-phenylhexanoate Traditional Name: 2-[[1-adamantyloxy-[1-(benzyloxycarbonylamino)-2-phenyl-ethyl]phosphoryl]methyl]-6-phenyl-hexanoic acid ethyl ester Formula: C41H52NO6P MolecularWeight: 685.828441

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCC1=CC=CC=C1)CP(=O)(C(CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)OC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CCOC(=O)C(CCCCC1=CC=CC=C1)CP(=O)(C(CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)OC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C41H52NO6P/c1-2-46-39(43)37(21-13-12-16-31-14-6-3-7-15-31)30-49(45,48-41-26-34-22-35(27-41)24-36(23-34)28-41)38(25-32-17-8-4-9-18-32)42-40(44)47-29-33-19-10-5-11-20-33/h3-11,14-15,17-20,34-38H,2,12-13,16,21-30H2,1H3,(H,42,44)