2-(azepan-1-yl)-1-(4-methoxyphenyl)propan-1-one

Systemtic Name: 2-(azepan-1-yl)-1-(4-methoxyphenyl)propan-1-one Openeye Name: 2-(azepan-1-yl)-1-(4-methoxyphenyl)propan-1-one CAS Name: 2-(1-azepanyl)-1-(4-methoxyphenyl)-1-propanone IUPAC Name: 2-(azepan-1-yl)-1-(4-methoxyphenyl)propan-1-one Traditional Name: 2-(azepan-1-yl)-1-(4-methoxyphenyl)propan-1-one Formula: C16H23NO2 MolecularWeight: 261.35932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23NO2/c1-13(17-11-5-3-4-6-12-17)16(18)14-7-9-15(19-2)10-8-14/h7-10,13H,3-6,11-12H2,1-2H3