(phenylmethyl) 4-(3,4-dimethylphenoxy)-3-oxidanyl-piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-(3,4-dimethylphenoxy)-3-oxidanyl-piperidine-1-carboxylate Openeye Name: benzyl 4-(3,4-dimethylphenoxy)-3-hydroxy-piperidine-1-carboxylate CAS Name: 4-(3,4-dimethylphenoxy)-3-hydroxy-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(3,4-dimethylphenoxy)-3-hydroxypiperidine-1-carboxylate Traditional Name: 4-(3,4-dimethylphenoxy)-3-hydroxy-piperidine-1-carboxylic acid benzyl ester Formula: C21H25NO4 MolecularWeight: 355.4275

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC2CCN(CC2O)C(=O)OCC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC2CCN(CC2O)C(=O)OCC3=CC=CC=C3)C

InChI

InChI=1S/C21H25NO4/c1-15-8-9-18(12-16(15)2)26-20-10-11-22(13-19(20)23)21(24)25-14-17-6-4-3-5-7-17/h3-9,12,19-20,23H,10-11,13-14H2,1-2H3