ethyl 1-heptyl-4-phenyl-piperidine-4-carboxylate

Systemtic Name: ethyl 1-heptyl-4-phenyl-piperidine-4-carboxylate Openeye Name: ethyl 1-heptyl-4-phenyl-piperidine-4-carboxylate CAS Name: 1-heptyl-4-phenyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-heptyl-4-phenylpiperidine-4-carboxylate Traditional Name: 1-heptyl-4-phenyl-isonipecotic acid ethyl ester Formula: C21H33NO2 MolecularWeight: 331.49222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1CCC(CC1)(C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCCCCCCN1CCC(CC1)(C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C21H33NO2/c1-3-5-6-7-11-16-22-17-14-21(15-18-22,20(23)24-4-2)19-12-9-8-10-13-19/h8-10,12-13H,3-7,11,14-18H2,1-2H3