1-(azepan-1-yl)-2-(2,4-dimethylphenoxy)propan-1-one

Systemtic Name: 1-(azepan-1-yl)-2-(2,4-dimethylphenoxy)propan-1-one Openeye Name: 1-(azepan-1-yl)-2-(2,4-dimethylphenoxy)propan-1-one CAS Name: 1-(1-azepanyl)-2-(2,4-dimethylphenoxy)-1-propanone IUPAC Name: 1-(azepan-1-yl)-2-(2,4-dimethylphenoxy)propan-1-one Traditional Name: 1-(azepan-1-yl)-2-(2,4-dimethylphenoxy)propan-1-one Formula: C17H25NO2 MolecularWeight: 275.3859

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(C)C(=O)N2CCCCCC2)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC(C)C(=O)N2CCCCCC2)C

InChI

InChI=1S/C17H25NO2/c1-13-8-9-16(14(2)12-13)20-15(3)17(19)18-10-6-4-5-7-11-18/h8-9,12,15H,4-7,10-11H2,1-3H3