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

Systemtic Name: ethyl 2-[[1-adamantyloxy-[1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-5-phenyl-pentanoate Openeye Name: ethyl 2-[[1-adamantyloxy-[1-(benzyloxycarbonylamino)ethyl]phosphoryl]methyl]-5-phenyl-pentanoate CAS Name: 2-[[1-adamantyloxy-[1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-5-phenylpentanoic acid ethyl ester IUPAC Name: ethyl 2-[[1-adamantyloxy-[1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]methyl]-5-phenylpentanoate Traditional Name: 2-[[1-adamantyloxy-[1-(benzyloxycarbonylamino)ethyl]phosphoryl]methyl]-5-phenyl-valeric acid ethyl ester Formula: C34H46NO6P MolecularWeight: 595.705901

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCC1=CC=CC=C1)CP(=O)(C(C)NC(=O)OCC2=CC=CC=C2)OC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCOC(=O)C(CCCC1=CC=CC=C1)CP(=O)(C(C)NC(=O)OCC2=CC=CC=C2)OC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C34H46NO6P/c1-3-39-32(36)31(16-10-15-26-11-6-4-7-12-26)24-42(38,25(2)35-33(37)40-23-27-13-8-5-9-14-27)41-34-20-28-17-29(21-34)19-30(18-28)22-34/h4-9,11-14,25,28-31H,3,10,15-24H2,1-2H3,(H,35,37)