1-[(3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethyl-piperidin-1-yl]heptan-1-one

Systemtic Name: 1-[(3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethyl-piperidin-1-yl]heptan-1-one Openeye Name: 1-[(3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidyl]heptan-1-one CAS Name: 1-[(3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidinyl]-1-heptanone IUPAC Name: 1-[(3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethylpiperidin-1-yl]heptan-1-one Traditional Name: 1-[(3R,4R)-4-(3-hydroxyphenyl)-3,4-dimethyl-piperidino]heptan-1-one Formula: C20H31NO2 MolecularWeight: 317.46564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)N1CCC(C(C1)C)(C)C2=CC(=CC=C2)O

Isomeric SMILES

CCCCCCC(=O)N1CC[C@@]([C@H](C1)C)(C)C2=CC(=CC=C2)O

InChI

InChI=1S/C20H31NO2/c1-4-5-6-7-11-19(23)21-13-12-20(3,16(2)15-21)17-9-8-10-18(22)14-17/h8-10,14,16,22H,4-7,11-13,15H2,1-3H3/t16-,20+/m0/s1