octyl 2,2,6,6-tetramethyl-4-[[(E)-3-phenylprop-2-enoyl]amino]piperidine-4-carboxylate

Systemtic Name: octyl 2,2,6,6-tetramethyl-4-[[(E)-3-phenylprop-2-enoyl]amino]piperidine-4-carboxylate Openeye Name: octyl 2,2,6,6-tetramethyl-4-[[(E)-3-phenylprop-2-enoyl]amino]piperidine-4-carboxylate CAS Name: 2,2,6,6-tetramethyl-4-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]-4-piperidinecarboxylic acid octyl ester IUPAC Name: octyl 2,2,6,6-tetramethyl-4-[[(E)-3-phenylprop-2-enoyl]amino]piperidine-4-carboxylate Traditional Name: 2,2,6,6-tetramethyl-4-[[(E)-3-phenylacryloyl]amino]isonipecotic acid octyl ester Formula: C27H42N2O3 MolecularWeight: 442.63398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1(CC(NC(C1)(C)C)(C)C)NC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCOC(=O)C1(CC(NC(C1)(C)C)(C)C)NC(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C27H42N2O3/c1-6-7-8-9-10-14-19-32-24(31)27(20-25(2,3)29-26(4,5)21-27)28-23(30)18-17-22-15-12-11-13-16-22/h11-13,15-18,29H,6-10,14,19-21H2,1-5H3,(H,28,30)/b18-17+