(3R)-3-(2-cyclopropylethyl)-3-(3-methoxyphenyl)-1-methyl-azepan-2-one

Systemtic Name: (3R)-3-(2-cyclopropylethyl)-3-(3-methoxyphenyl)-1-methyl-azepan-2-one Openeye Name: (3R)-3-(2-cyclopropylethyl)-3-(3-methoxyphenyl)-1-methyl-azepan-2-one CAS Name: (3R)-3-(2-cyclopropylethyl)-3-(3-methoxyphenyl)-1-methyl-2-azepanone IUPAC Name: (3R)-3-(2-cyclopropylethyl)-3-(3-methoxyphenyl)-1-methylazepan-2-one Traditional Name: (3R)-3-(2-cyclopropylethyl)-3-(3-methoxyphenyl)-1-methyl-azepan-2-one Formula: C19H27NO2 MolecularWeight: 301.42318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCCCC(C1=O)(CCC2CC2)C3=CC(=CC=C3)OC

Isomeric SMILES

CN1CCCC[C@@](C1=O)(CCC2CC2)C3=CC(=CC=C3)OC

InChI

InChI=1S/C19H27NO2/c1-20-13-4-3-11-19(18(20)21,12-10-15-8-9-15)16-6-5-7-17(14-16)22-2/h5-7,14-15H,3-4,8-13H2,1-2H3/t19-/m1/s1