3-(diethylamino)propyl 3-methylsulfanylbenzoate

Systemtic Name: 3-(diethylamino)propyl 3-methylsulfanylbenzoate Openeye Name: 3-(diethylamino)propyl 3-methylsulfanylbenzoate CAS Name: 3-(methylthio)benzoic acid 3-(diethylamino)propyl ester IUPAC Name: 3-(diethylamino)propyl 3-methylsulfanylbenzoate Traditional Name: 3-(methylthio)benzoic acid 3-(diethylamino)propyl ester Formula: C15H23NO2S MolecularWeight: 281.41362

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCOC(=O)C1=CC(=CC=C1)SC

Isomeric SMILES

CCN(CC)CCCOC(=O)C1=CC(=CC=C1)SC

InChI

InChI=1S/C15H23NO2S/c1-4-16(5-2)10-7-11-18-15(17)13-8-6-9-14(12-13)19-3/h6,8-9,12H,4-5,7,10-11H2,1-3H3