3-(azepan-1-yl)-1-[3-ethyl-4-(2-hexoxyethoxy)phenyl]propan-1-one

Systemtic Name: 3-(azepan-1-yl)-1-[3-ethyl-4-(2-hexoxyethoxy)phenyl]propan-1-one Openeye Name: 3-(azepan-1-yl)-1-[3-ethyl-4-(2-hexoxyethoxy)phenyl]propan-1-one CAS Name: 3-(1-azepanyl)-1-[3-ethyl-4-(2-hexoxyethoxy)phenyl]-1-propanone IUPAC Name: 3-(azepan-1-yl)-1-[3-ethyl-4-(2-hexoxyethoxy)phenyl]propan-1-one Traditional Name: 3-(azepan-1-yl)-1-[3-ethyl-4-(2-hexoxyethoxy)phenyl]propan-1-one Formula: C25H41NO3 MolecularWeight: 403.59794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOCCOC1=C(C=C(C=C1)C(=O)CCN2CCCCCC2)CC

Isomeric SMILES

CCCCCCOCCOC1=C(C=C(C=C1)C(=O)CCN2CCCCCC2)CC

InChI

InChI=1S/C25H41NO3/c1-3-5-6-11-18-28-19-20-29-25-13-12-23(21-22(25)4-2)24(27)14-17-26-15-9-7-8-10-16-26/h12-13,21H,3-11,14-20H2,1-2H3