methyl 4-[[3-(4-cyanophenyl)-1-(4-oxidanylpiperidin-4-yl)propyl]amino]benzoate

Systemtic Name: methyl 4-[[3-(4-cyanophenyl)-1-(4-oxidanylpiperidin-4-yl)propyl]amino]benzoate Openeye Name: methyl 4-[[3-(4-cyanophenyl)-1-(4-hydroxy-4-piperidyl)propyl]amino]benzoate CAS Name: 4-[[3-(4-cyanophenyl)-1-(4-hydroxy-4-piperidinyl)propyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(4-cyanophenyl)-1-(4-hydroxypiperidin-4-yl)propyl]amino]benzoate Traditional Name: 4-[[3-(4-cyanophenyl)-1-(4-hydroxy-4-piperidyl)propyl]amino]benzoic acid methyl ester Formula: C23H27N3O3 MolecularWeight: 393.47878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(CCC2=CC=C(C=C2)C#N)C3(CCNCC3)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(CCC2=CC=C(C=C2)C#N)C3(CCNCC3)O

InChI

InChI=1S/C23H27N3O3/c1-29-22(27)19-7-9-20(10-8-19)26-21(23(28)12-14-25-15-13-23)11-6-17-2-4-18(16-24)5-3-17/h2-5,7-10,21,25-26,28H,6,11-15H2,1H3