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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC(C)C(=O)N2CCCN(CC2)C(=O)C(C)OC3=CC=CC=C3C

Isomeric SMILES

CC1=CC=CC=C1OC(C)C(=O)N2CCCN(CC2)C(=O)C(C)OC3=CC=CC=C3C

InChI

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