2-[(6-chloranyl-7-oxidanidyl-2-oxidanylidene-chromen-3-yl)carbonylamino]ethyl (3-pentadec-1-en-2-yloxy-2-tetradecanoyloxy-propyl) phosphate

Systemtic Name: 2-[(6-chloranyl-7-oxidanidyl-2-oxidanylidene-chromen-3-yl)carbonylamino]ethyl (3-pentadec-1-en-2-yloxy-2-tetradecanoyloxy-propyl) phosphate Openeye Name: 2-[(6-chloro-7-oxido-2-oxo-chromene-3-carbonyl)amino]ethyl [3-(1-methylenetetradecoxy)-2-tetradecanoyloxy-propyl] phosphate CAS Name: 2-[[(6-chloro-7-oxido-2-oxo-1-benzopyran-3-yl)-oxomethyl]amino]ethyl [2-(1-oxotetradecoxy)-3-pentadec-1-en-2-yloxypropyl] phosphate IUPAC Name: 2-[(6-chloro-7-oxido-2-oxochromene-3-carbonyl)amino]ethyl (3-pentadec-1-en-2-yloxy-2-tetradecanoyloxypropyl) phosphate Traditional Name: 2-[(6-chloro-2-keto-7-oxido-chromene-3-carbonyl)amino]ethyl [2-tetradecanoyloxy-3-(1-tridecylvinyloxy)propyl] phosphate Formula: C44H69ClNO11P-2 MolecularWeight: 854.445521

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=C)OCC(COP(=O)([O-])OCCNC(=O)C1=CC2=CC(=C(C=C2OC1=O)[O-])Cl)OC(=O)CCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCC(=C)OCC(COP(=O)([O-])OCCNC(=O)C1=CC2=CC(=C(C=C2OC1=O)[O-])Cl)OC(=O)CCCCCCCCCCCCC

InChI

InChI=1S/C44H71ClNO11P/c1-4-6-8-10-12-14-16-18-20-22-24-26-35(3)53-33-37(56-42(48)27-25-23-21-19-17-15-13-11-9-7-5-2)34-55-58(51,52)54-29-28-46-43(49)38-30-36-31-39(45)40(47)32-41(36)57-44(38)50/h30-32,37,47H,3-29,33-34H2,1-2H3,(H,46,49)(H,51,52)/p-2