[1-[[5-azanyl-1-diphenoxyphosphoryloxy-10-oxidanyl-4-oxidanylidene-9-(3-phenylmethoxytetradecanoylamino)decan-3-yl]amino]-1-oxidanylidene-tetradecan-3-yl] dodecanoate

Systemtic Name: [1-[[5-azanyl-1-diphenoxyphosphoryloxy-10-oxidanyl-4-oxidanylidene-9-(3-phenylmethoxytetradecanoylamino)decan-3-yl]amino]-1-oxidanylidene-tetradecan-3-yl] dodecanoate Openeye Name: 1-[2-[[3-amino-7-(3-benzyloxytetradecanoylamino)-1-(2-diphenoxyphosphoryloxyethyl)-8-hydroxy-2-oxo-octyl]amino]-2-oxo-ethyl]dodecyl dodecanoate CAS Name: dodecanoic acid [1-[[5-amino-1-diphenoxyphosphoryloxy-10-hydroxy-4-oxo-9-[(1-oxo-3-phenylmethoxytetradecyl)amino]decan-3-yl]amino]-1-oxotetradecan-3-yl] ester IUPAC Name: [1-[[5-amino-1-diphenoxyphosphoryloxy-10-hydroxy-4-oxo-9-(3-phenylmethoxytetradecanoylamino)decan-3-yl]amino]-1-oxotetradecan-3-yl] dodecanoate Traditional Name: lauric acid 1-[2-[[3-amino-7-(3-benzoxytetradecanoylamino)-1-(2-diphenoxyphosphoryloxyethyl)-8-hydroxy-2-keto-octyl]amino]-2-keto-ethyl]dodecyl ester Formula: C69H112N3O11P MolecularWeight: 1190.614841

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CC(=O)NC(CCCC(C(=O)C(CCOP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2)NC(=O)CC(CCCCCCCCCCC)OC(=O)CCCCCCCCCCC)N)CO)OCC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCC(CC(=O)NC(CCCC(C(=O)C(CCOP(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2)NC(=O)CC(CCCCCCCCCCC)OC(=O)CCCCCCCCCCC)N)CO)OCC3=CC=CC=C3

InChI

InChI=1S/C69H112N3O11P/c1-4-7-10-13-16-19-22-25-33-48-62(79-57-58-41-31-28-32-42-58)54-66(74)71-59(56-73)43-40-50-64(70)69(77)65(52-53-80-84(78,82-60-44-35-29-36-45-60)83-61-46-37-30-38-47-61)72-67(75)55-63(49-34-26-23-20-17-14-11-8-5-2)81-68(76)51-39-27-24-21-18-15-12-9-6-3/h28-32,35-38,41-42,44-47,59,62-65,73H,4-27,33-34,39-40,43,48-57,70H2,1-3H3,(H,71,74)(H,72,75)