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

Systemtic Name: 2,7-bis[(tert-butylamino)methyl]-1,8-bis(4-propoxyphenyl)octane-1,8-dione Openeye Name: 2,7-bis[(tert-butylamino)methyl]-1,8-bis(4-propoxyphenyl)octane-1,8-dione CAS Name: 2,7-bis[(tert-butylamino)methyl]-1,8-bis(4-propoxyphenyl)octane-1,8-dione IUPAC Name: 2,7-bis[(tert-butylamino)methyl]-1,8-bis(4-propoxyphenyl)octane-1,8-dione Traditional Name: 2,7-bis[(tert-butylamino)methyl]-1,8-bis(4-propoxyphenyl)octane-1,8-dione Formula: C36H56N2O4 MolecularWeight: 580.84084

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)C(CCCCC(CNC(C)(C)C)C(=O)C2=CC=C(C=C2)OCCC)CNC(C)(C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)C(CCCCC(CNC(C)(C)C)C(=O)C2=CC=C(C=C2)OCCC)CNC(C)(C)C

InChI

InChI=1S/C36H56N2O4/c1-9-23-41-31-19-15-27(16-20-31)33(39)29(25-37-35(3,4)5)13-11-12-14-30(26-38-36(6,7)8)34(40)28-17-21-32(22-18-28)42-24-10-2/h15-22,29-30,37-38H,9-14,23-26H2,1-8H3