2-(3-methylphenoxy)-1-[4-[2-(3-methylphenoxy)propanoyl]-1,4-diazepan-1-yl]propan-1-one

Systemtic Name: 2-(3-methylphenoxy)-1-[4-[2-(3-methylphenoxy)propanoyl]-1,4-diazepan-1-yl]propan-1-one Openeye Name: 2-(3-methylphenoxy)-1-[4-[2-(3-methylphenoxy)propanoyl]-1,4-diazepan-1-yl]propan-1-one CAS Name: 2-(3-methylphenoxy)-1-[4-[2-(3-methylphenoxy)-1-oxopropyl]-1,4-diazepan-1-yl]-1-propanone IUPAC Name: 2-(3-methylphenoxy)-1-[4-[2-(3-methylphenoxy)propanoyl]-1,4-diazepan-1-yl]propan-1-one Traditional Name: 2-(3-methylphenoxy)-1-[4-[2-(3-methylphenoxy)propanoyl]-1,4-diazepan-1-yl]propan-1-one Formula: C25H32N2O4 MolecularWeight: 424.53258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(C)C(=O)N2CCCN(CC2)C(=O)C(C)OC3=CC=CC(=C3)C

Isomeric SMILES

CC1=CC(=CC=C1)OC(C)C(=O)N2CCCN(CC2)C(=O)C(C)OC3=CC=CC(=C3)C

InChI

InChI=1S/C25H32N2O4/c1-18-8-5-10-22(16-18)30-20(3)24(28)26-12-7-13-27(15-14-26)25(29)21(4)31-23-11-6-9-19(2)17-23/h5-6,8-11,16-17,20-21H,7,12-15H2,1-4H3