(3R)-1-methyl-3-(3-propoxyphenyl)azepan-2-one

Systemtic Name: (3R)-1-methyl-3-(3-propoxyphenyl)azepan-2-one Openeye Name: (3R)-1-methyl-3-(3-propoxyphenyl)azepan-2-one CAS Name: (3R)-1-methyl-3-(3-propoxyphenyl)-2-azepanone IUPAC Name: (3R)-1-methyl-3-(3-propoxyphenyl)azepan-2-one Traditional Name: (3R)-1-methyl-3-(3-propoxyphenyl)azepan-2-one Formula: C16H23NO2 MolecularWeight: 261.35932

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C2CCCCN(C2=O)C

Isomeric SMILES

CCCOC1=CC=CC(=C1)[C@H]2CCCCN(C2=O)C

InChI

InChI=1S/C16H23NO2/c1-3-11-19-14-8-6-7-13(12-14)15-9-4-5-10-17(2)16(15)18/h6-8,12,15H,3-5,9-11H2,1-2H3/t15-/m1/s1