4-[8-[4-(2-diethylaminoethyloxy)phenoxy]octyl]heptane-3,5-dione

Systemtic Name: 4-[8-[4-(2-diethylaminoethyloxy)phenoxy]octyl]heptane-3,5-dione Openeye Name: 4-[8-[4-(2-diethylaminoethyloxy)phenoxy]octyl]heptane-3,5-dione CAS Name: 4-[8-[4-(2-diethylaminoethyloxy)phenoxy]octyl]heptane-3,5-dione IUPAC Name: 4-[8-[4-(2-diethylaminoethyloxy)phenoxy]octyl]heptane-3,5-dione Traditional Name: 4-[8-[4-(2-diethylaminoethyloxy)phenoxy]octyl]heptane-3,5-dione Formula: C27H45NO4 MolecularWeight: 447.6505

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(CCCCCCCCOC1=CC=C(C=C1)OCCN(CC)CC)C(=O)CC

Isomeric SMILES

CCC(=O)C(CCCCCCCCOC1=CC=C(C=C1)OCCN(CC)CC)C(=O)CC

InChI

InChI=1S/C27H45NO4/c1-5-26(29)25(27(30)6-2)15-13-11-9-10-12-14-21-31-23-16-18-24(19-17-23)32-22-20-28(7-3)8-4/h16-19,25H,5-15,20-22H2,1-4H3