[3-[(5-azanyl-1,3,3-trimethyl-cyclohexyl)methylamino]-2-oxidanyl-propyl] 2-methyl-2-nonyl-undecanoate

Systemtic Name: [3-[(5-azanyl-1,3,3-trimethyl-cyclohexyl)methylamino]-2-oxidanyl-propyl] 2-methyl-2-nonyl-undecanoate Openeye Name: [3-[(5-amino-1,3,3-trimethyl-cyclohexyl)methylamino]-2-hydroxy-propyl] 2-methyl-2-nonyl-undecanoate CAS Name: 2-methyl-2-nonylundecanoic acid [3-[(5-amino-1,3,3-trimethylcyclohexyl)methylamino]-2-hydroxypropyl] ester IUPAC Name: [3-[(5-amino-1,3,3-trimethylcyclohexyl)methylamino]-2-hydroxypropyl] 2-methyl-2-nonylundecanoate Traditional Name: 2-methyl-2-nonyl-undecanoic acid [3-[(5-amino-1,3,3-trimethyl-cyclohexyl)methylamino]-2-hydroxy-propyl] ester Formula: C34H68N2O3 MolecularWeight: 552.91532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C)(CCCCCCCCC)C(=O)OCC(CNCC1(CC(CC(C1)(C)C)N)C)O

Isomeric SMILES

CCCCCCCCCC(C)(CCCCCCCCC)C(=O)OCC(CNCC1(CC(CC(C1)(C)C)N)C)O

InChI

InChI=1S/C34H68N2O3/c1-7-9-11-13-15-17-19-21-34(6,22-20-18-16-14-12-10-8-2)31(38)39-26-30(37)25-36-28-33(5)24-29(35)23-32(3,4)27-33/h29-30,36-37H,7-28,35H2,1-6H3