3-(4-pentylpiperidin-1-yl)propyl benzoate

Systemtic Name: 3-(4-pentylpiperidin-1-yl)propyl benzoate Openeye Name: 3-(4-pentyl-1-piperidyl)propyl benzoate CAS Name: benzoic acid 3-(4-pentyl-1-piperidinyl)propyl ester IUPAC Name: 3-(4-pentylpiperidin-1-yl)propyl benzoate Traditional Name: benzoic acid 3-(4-amylpiperidino)propyl ester Formula: C20H31NO2 MolecularWeight: 317.46564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCN(CC1)CCCOC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCC1CCN(CC1)CCCOC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H31NO2/c1-2-3-5-9-18-12-15-21(16-13-18)14-8-17-23-20(22)19-10-6-4-7-11-19/h4,6-7,10-11,18H,2-3,5,8-9,12-17H2,1H3