tert-butyl 3-[[(E)-octadec-9-enoyl]amino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[[(E)-octadec-9-enoyl]amino]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[[(E)-octadec-9-enoyl]amino]piperidine-1-carboxylate CAS Name: 3-[[(E)-1-oxooctadec-9-enyl]amino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[(E)-octadec-9-enoyl]amino]piperidine-1-carboxylate Traditional Name: 3-[[(E)-octadec-9-enoyl]amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C28H52N2O3 MolecularWeight: 464.72408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)NC1CCCN(C1)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)NC1CCCN(C1)C(=O)OC(C)(C)C

InChI

InChI=1S/C28H52N2O3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-26(31)29-25-21-20-23-30(24-25)27(32)33-28(2,3)4/h12-13,25H,5-11,14-24H2,1-4H3,(H,29,31)/b13-12+