3-(2-hexylpiperidin-1-yl)propyl benzoate

Systemtic Name: 3-(2-hexylpiperidin-1-yl)propyl benzoate Openeye Name: 3-(2-hexyl-1-piperidyl)propyl benzoate CAS Name: benzoic acid 3-(2-hexyl-1-piperidinyl)propyl ester IUPAC Name: 3-(2-hexylpiperidin-1-yl)propyl benzoate Traditional Name: benzoic acid 3-(2-hexylpiperidino)propyl ester Formula: C21H33NO2 MolecularWeight: 331.49222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCCCN1CCCOC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCC1CCCCN1CCCOC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H33NO2/c1-2-3-4-8-14-20-15-9-10-16-22(20)17-11-18-24-21(23)19-12-6-5-7-13-19/h5-7,12-13,20H,2-4,8-11,14-18H2,1H3