[3-[bis(2-chloroethyl)amino-phenoxy-phosphoryl]oxy-2-decanoyloxy-propyl] decanoate

Systemtic Name: [3-[bis(2-chloroethyl)amino-phenoxy-phosphoryl]oxy-2-decanoyloxy-propyl] decanoate Openeye Name: [3-[bis(2-chloroethyl)amino-phenoxy-phosphoryl]oxy-2-decanoyloxy-propyl] decanoate CAS Name: decanoic acid [3-[bis(2-chloroethyl)amino-phenoxyphosphoryl]oxy-2-(1-oxodecoxy)propyl] ester IUPAC Name: [3-[bis(2-chloroethyl)amino-phenoxyphosphoryl]oxy-2-decanoyloxypropyl] decanoate Traditional Name: capric acid [3-[bis(2-chloroethyl)amino-phenoxy-phosphoryl]oxy-2-capryloxy-propyl] ester Formula: C33H56Cl2NO7P MolecularWeight: 680.680001

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)OCC(COP(=O)(N(CCCl)CCCl)OC1=CC=CC=C1)OC(=O)CCCCCCCCC

Isomeric SMILES

CCCCCCCCCC(=O)OCC(COP(=O)(N(CCCl)CCCl)OC1=CC=CC=C1)OC(=O)CCCCCCCCC

InChI

InChI=1S/C33H56Cl2NO7P/c1-3-5-7-9-11-13-18-22-32(37)40-28-31(42-33(38)23-19-14-12-10-8-6-4-2)29-41-44(39,36(26-24-34)27-25-35)43-30-20-16-15-17-21-30/h15-17,20-21,31H,3-14,18-19,22-29H2,1-2H3