bis[[4-[(dibutylamino)methyl]phenyl]methyl] carbonate dihydrochloride

Systemtic Name: bis[[4-[(dibutylamino)methyl]phenyl]methyl] carbonate dihydrochloride Openeye Name: bis[[4-[(dibutylamino)methyl]phenyl]methyl] carbonate dihydrochloride CAS Name: carbonic acid bis[[4-[(dibutylamino)methyl]phenyl]methyl] ester dihydrochloride IUPAC Name: bis[[4-[(dibutylamino)methyl]phenyl]methyl] carbonate dihydrochloride Traditional Name: carbonic acid bis[4-[(dibutylamino)methyl]benzyl] ester dihydrochloride Formula: C33H54Cl2N2O3 MolecularWeight: 597.69946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CC1=CC=C(C=C1)COC(=O)OCC2=CC=C(C=C2)CN(CCCC)CCCC.Cl.Cl

Isomeric SMILES

CCCCN(CCCC)CC1=CC=C(C=C1)COC(=O)OCC2=CC=C(C=C2)CN(CCCC)CCCC.Cl.Cl

InChI

InChI=1S/C33H52N2O3.2ClH/c1-5-9-21-34(22-10-6-2)25-29-13-17-31(18-14-29)27-37-33(36)38-28-32-19-15-30(16-20-32)26-35(23-11-7-3)24-12-8-4;;/h13-20H,5-12,21-28H2,1-4H3;2*1H