[(E)-4-[2-[(2E)-penta-2,4-dienyl]piperidin-1-yl]but-2-enyl] benzoate

Systemtic Name: [(E)-4-[2-[(2E)-penta-2,4-dienyl]piperidin-1-yl]but-2-enyl] benzoate Openeye Name: [(E)-4-[2-[(2E)-penta-2,4-dienyl]-1-piperidyl]but-2-enyl] benzoate CAS Name: benzoic acid [(E)-4-[2-[(2E)-penta-2,4-dienyl]-1-piperidinyl]but-2-enyl] ester IUPAC Name: [(E)-4-[2-[(2E)-penta-2,4-dienyl]piperidin-1-yl]but-2-enyl] benzoate Traditional Name: benzoic acid [(E)-4-[2-[(2E)-penta-2,4-dienyl]piperidino]but-2-enyl] ester Formula: C21H27NO2 MolecularWeight: 325.44458

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Descriptors Computed from Structure

Canonical SMILES:

C=CC=CCC1CCCCN1CC=CCOC(=O)C2=CC=CC=C2

Isomeric SMILES

C=C/C=C/CC1CCCCN1C/C=C/COC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H27NO2/c1-2-3-5-14-20-15-8-9-16-22(20)17-10-11-18-24-21(23)19-12-6-4-7-13-19/h2-7,10-13,20H,1,8-9,14-18H2/b5-3+,11-10+