methyl 1-[2-(2,5-dimethylphenoxy)butanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-(2,5-dimethylphenoxy)butanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-(2,5-dimethylphenoxy)butanoyl]piperidine-4-carboxylate CAS Name: 1-[2-(2,5-dimethylphenoxy)-1-oxobutyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(2,5-dimethylphenoxy)butanoyl]piperidine-4-carboxylate Traditional Name: 1-[2-(2,5-dimethylphenoxy)butanoyl]isonipecotic acid methyl ester Formula: C19H27NO4 MolecularWeight: 333.42198

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCC(CC1)C(=O)OC)OC2=C(C=CC(=C2)C)C

Isomeric SMILES

CCC(C(=O)N1CCC(CC1)C(=O)OC)OC2=C(C=CC(=C2)C)C

InChI

InChI=1S/C19H27NO4/c1-5-16(24-17-12-13(2)6-7-14(17)3)18(21)20-10-8-15(9-11-20)19(22)23-4/h6-7,12,15-16H,5,8-11H2,1-4H3