ethyl 1-[(E)-octadec-9-enoyl]-4-phenyl-piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(E)-octadec-9-enoyl]-4-phenyl-piperidine-4-carboxylate Openeye Name: ethyl 1-[(E)-octadec-9-enoyl]-4-phenyl-piperidine-4-carboxylate CAS Name: 1-[(E)-1-oxooctadec-9-enyl]-4-phenyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(E)-octadec-9-enoyl]-4-phenylpiperidine-4-carboxylate Traditional Name: 1-[(E)-octadec-9-enoyl]-4-phenyl-isonipecotic acid ethyl ester Formula: C32H51NO3 MolecularWeight: 497.75224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)N1CCC(CC1)(C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)N1CCC(CC1)(C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C32H51NO3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-21-24-30(34)33-27-25-32(26-28-33,31(35)36-4-2)29-22-19-18-20-23-29/h11-12,18-20,22-23H,3-10,13-17,21,24-28H2,1-2H3/b12-11+