3-(diethylamino)propyl 2-propylsulfanylbenzoate

Systemtic Name: 3-(diethylamino)propyl 2-propylsulfanylbenzoate Openeye Name: 3-(diethylamino)propyl 2-propylsulfanylbenzoate CAS Name: 2-(propylthio)benzoic acid 3-(diethylamino)propyl ester IUPAC Name: 3-(diethylamino)propyl 2-propylsulfanylbenzoate Traditional Name: 2-(propylthio)benzoic acid 3-(diethylamino)propyl ester Formula: C17H27NO2S MolecularWeight: 309.46678

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC=CC=C1C(=O)OCCCN(CC)CC

Isomeric SMILES

CCCSC1=CC=CC=C1C(=O)OCCCN(CC)CC

InChI

InChI=1S/C17H27NO2S/c1-4-14-21-16-11-8-7-10-15(16)17(19)20-13-9-12-18(5-2)6-3/h7-8,10-11H,4-6,9,12-14H2,1-3H3