[1-(2,6-dimethylpiperidin-1-yl)-3-phenoxy-propan-2-yl] 4-chloranylbenzoate

Systemtic Name: [1-(2,6-dimethylpiperidin-1-yl)-3-phenoxy-propan-2-yl] 4-chloranylbenzoate Openeye Name: [1-[(2,6-dimethyl-1-piperidyl)methyl]-2-phenoxy-ethyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [1-(2,6-dimethyl-1-piperidinyl)-3-phenoxypropan-2-yl] ester IUPAC Name: [1-(2,6-dimethylpiperidin-1-yl)-3-phenoxypropan-2-yl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [1-[(2,6-dimethylpiperidino)methyl]-2-phenoxy-ethyl] ester Formula: C23H28ClNO3 MolecularWeight: 401.92632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1CC(COC2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1CCCC(N1CC(COC2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C23H28ClNO3/c1-17-7-6-8-18(2)25(17)15-22(16-27-21-9-4-3-5-10-21)28-23(26)19-11-13-20(24)14-12-19/h3-5,9-14,17-18,22H,6-8,15-16H2,1-2H3