1-(azepan-1-yl)-2-(4-chloranyl-2-methyl-phenoxy)propan-1-one

Systemtic Name: 1-(azepan-1-yl)-2-(4-chloranyl-2-methyl-phenoxy)propan-1-one Openeye Name: 1-(azepan-1-yl)-2-(4-chloro-2-methyl-phenoxy)propan-1-one CAS Name: 1-(1-azepanyl)-2-(4-chloro-2-methylphenoxy)-1-propanone IUPAC Name: 1-(azepan-1-yl)-2-(4-chloro-2-methylphenoxy)propan-1-one Traditional Name: 1-(azepan-1-yl)-2-(4-chloro-2-methyl-phenoxy)propan-1-one Formula: C16H22ClNO2 MolecularWeight: 295.80438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22ClNO2/c1-12-11-14(17)7-8-15(12)20-13(2)16(19)18-9-5-3-4-6-10-18/h7-8,11,13H,3-6,9-10H2,1-2H3