3-(3-hydroxyphenyl)-1-methyl-azepan-2-one

Systemtic Name: 3-(3-hydroxyphenyl)-1-methyl-azepan-2-one Openeye Name: 3-(3-hydroxyphenyl)-1-methyl-azepan-2-one CAS Name: 3-(3-hydroxyphenyl)-1-methyl-2-azepanone IUPAC Name: 3-(3-hydroxyphenyl)-1-methylazepan-2-one Traditional Name: 3-(3-hydroxyphenyl)-1-methyl-azepan-2-one Formula: C13H17NO2 MolecularWeight: 219.27958

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCCC(C1=O)C2=CC(=CC=C2)O

Isomeric SMILES

CN1CCCCC(C1=O)C2=CC(=CC=C2)O

InChI

InChI=1S/C13H17NO2/c1-14-8-3-2-7-12(13(14)16)10-5-4-6-11(15)9-10/h4-6,9,12,15H,2-3,7-8H2,1H3