bis[[3-(diethylamino)phenyl]methyl] hexanedioate

Systemtic Name: bis[[3-(diethylamino)phenyl]methyl] hexanedioate Openeye Name: bis[[3-(diethylamino)phenyl]methyl] hexanedioate CAS Name: hexanedioic acid bis[[3-(diethylamino)phenyl]methyl] ester IUPAC Name: bis[[3-(diethylamino)phenyl]methyl] hexanedioate Traditional Name: adipic acid bis[3-(diethylamino)benzyl] ester Formula: C28H40N2O4 MolecularWeight: 468.6282

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=CC(=C1)COC(=O)CCCCC(=O)OCC2=CC(=CC=C2)N(CC)CC

Isomeric SMILES

CCN(CC)C1=CC=CC(=C1)COC(=O)CCCCC(=O)OCC2=CC(=CC=C2)N(CC)CC

InChI

InChI=1S/C28H40N2O4/c1-5-29(6-2)25-15-11-13-23(19-25)21-33-27(31)17-9-10-18-28(32)34-22-24-14-12-16-26(20-24)30(7-3)8-4/h11-16,19-20H,5-10,17-18,21-22H2,1-4H3