2,5-bis(1-azanyl-2,2-dimethyl-propyl)-1,6-bis(4-butoxyphenyl)hexane-1,6-dione

Systemtic Name: 2,5-bis(1-azanyl-2,2-dimethyl-propyl)-1,6-bis(4-butoxyphenyl)hexane-1,6-dione Openeye Name: 2,5-bis(1-amino-2,2-dimethyl-propyl)-1,6-bis(4-butoxyphenyl)hexane-1,6-dione CAS Name: 2,5-bis(1-amino-2,2-dimethylpropyl)-1,6-bis(4-butoxyphenyl)hexane-1,6-dione IUPAC Name: 2,5-bis(1-amino-2,2-dimethylpropyl)-1,6-bis(4-butoxyphenyl)hexane-1,6-dione Traditional Name: 2,5-bis(1-amino-2,2-dimethyl-propyl)-1,6-bis(4-butoxyphenyl)hexane-1,6-dione Formula: C36H56N2O4 MolecularWeight: 580.84084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)C(CCC(C(C(C)(C)C)N)C(=O)C2=CC=C(C=C2)OCCCC)C(C(C)(C)C)N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)C(CCC(C(C(C)(C)C)N)C(=O)C2=CC=C(C=C2)OCCCC)C(C(C)(C)C)N

InChI

InChI=1S/C36H56N2O4/c1-9-11-23-41-27-17-13-25(14-18-27)31(39)29(33(37)35(3,4)5)21-22-30(34(38)36(6,7)8)32(40)26-15-19-28(20-16-26)42-24-12-10-2/h13-20,29-30,33-34H,9-12,21-24,37-38H2,1-8H3