2,7-bis(diethylaminomethyl)-1,8-bis(4-pentoxyphenyl)octane-1,8-dione

Systemtic Name: 2,7-bis(diethylaminomethyl)-1,8-bis(4-pentoxyphenyl)octane-1,8-dione Openeye Name: 2,7-bis(diethylaminomethyl)-1,8-bis(4-pentoxyphenyl)octane-1,8-dione CAS Name: 2,7-bis(diethylaminomethyl)-1,8-bis(4-pentoxyphenyl)octane-1,8-dione IUPAC Name: 2,7-bis(diethylaminomethyl)-1,8-bis(4-pentoxyphenyl)octane-1,8-dione Traditional Name: 1,8-bis(4-amoxyphenyl)-2,7-bis(diethylaminomethyl)octane-1,8-dione Formula: C40H64N2O4 MolecularWeight: 636.94716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)C(CCCCC(CN(CC)CC)C(=O)C2=CC=C(C=C2)OCCCCC)CN(CC)CC

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)C(CCCCC(CN(CC)CC)C(=O)C2=CC=C(C=C2)OCCCCC)CN(CC)CC

InChI

InChI=1S/C40H64N2O4/c1-7-13-17-29-45-37-25-21-33(22-26-37)39(43)35(31-41(9-3)10-4)19-15-16-20-36(32-42(11-5)12-6)40(44)34-23-27-38(28-24-34)46-30-18-14-8-2/h21-28,35-36H,7-20,29-32H2,1-6H3