octyl 3-(phenethylamino)butanoate

Systemtic Name: octyl 3-(phenethylamino)butanoate Openeye Name: octyl 3-(phenethylamino)butanoate CAS Name: 3-(phenethylamino)butanoic acid octyl ester IUPAC Name: octyl 3-(phenethylamino)butanoate Traditional Name: 3-(phenethylamino)butyric acid octyl ester Formula: C20H33NO2 MolecularWeight: 319.48152

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)CC(C)NCCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCOC(=O)CC(C)NCCC1=CC=CC=C1

InChI

InChI=1S/C20H33NO2/c1-3-4-5-6-7-11-16-23-20(22)17-18(2)21-15-14-19-12-9-8-10-13-19/h8-10,12-13,18,21H,3-7,11,14-17H2,1-2H3