2,7-bis[(tert-butylamino)methyl]-1,8-bis(4-ethoxyphenyl)octane-1,8-dione

Systemtic Name: 2,7-bis[(tert-butylamino)methyl]-1,8-bis(4-ethoxyphenyl)octane-1,8-dione Openeye Name: 2,7-bis[(tert-butylamino)methyl]-1,8-bis(4-ethoxyphenyl)octane-1,8-dione CAS Name: 2,7-bis[(tert-butylamino)methyl]-1,8-bis(4-ethoxyphenyl)octane-1,8-dione IUPAC Name: 2,7-bis[(tert-butylamino)methyl]-1,8-bis(4-ethoxyphenyl)octane-1,8-dione Traditional Name: 2,7-bis[(tert-butylamino)methyl]-1,8-bis(p-phenetyl)octane-1,8-dione Formula: C34H52N2O4 MolecularWeight: 552.78768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)C(CCCCC(CNC(C)(C)C)C(=O)C2=CC=C(C=C2)OCC)CNC(C)(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)C(CCCCC(CNC(C)(C)C)C(=O)C2=CC=C(C=C2)OCC)CNC(C)(C)C

InChI

InChI=1S/C34H52N2O4/c1-9-39-29-19-15-25(16-20-29)31(37)27(23-35-33(3,4)5)13-11-12-14-28(24-36-34(6,7)8)32(38)26-17-21-30(22-18-26)40-10-2/h15-22,27-28,35-36H,9-14,23-24H2,1-8H3