1-[2-(3,4-dimethylphenoxy)ethanoyl]piperidine-4-carboxylate

Systemtic Name: 1-[2-(3,4-dimethylphenoxy)ethanoyl]piperidine-4-carboxylate Openeye Name: 1-[2-(3,4-dimethylphenoxy)acetyl]piperidine-4-carboxylate CAS Name: 1-[2-(3,4-dimethylphenoxy)-1-oxoethyl]-4-piperidinecarboxylate IUPAC Name: 1-[2-(3,4-dimethylphenoxy)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(3,4-dimethylphenoxy)acetyl]isonipecotate Formula: C16H20NO4- MolecularWeight: 290.3343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC(=O)N2CCC(CC2)C(=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC(=O)N2CCC(CC2)C(=O)[O-])C

InChI

InChI=1S/C16H21NO4/c1-11-3-4-14(9-12(11)2)21-10-15(18)17-7-5-13(6-8-17)16(19)20/h3-4,9,13H,5-8,10H2,1-2H3,(H,19,20)/p-1