2-diethylaminoethyl 3-methylsulfanylbenzoate

Systemtic Name: 2-diethylaminoethyl 3-methylsulfanylbenzoate Openeye Name: 2-diethylaminoethyl 3-methylsulfanylbenzoate CAS Name: 3-(methylthio)benzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 3-methylsulfanylbenzoate Traditional Name: 3-(methylthio)benzoic acid 2-diethylaminoethyl ester Formula: C14H21NO2S MolecularWeight: 267.38704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21NO2S/c1-4-15(5-2)9-10-17-14(16)12-7-6-8-13(11-12)18-3/h6-8,11H,4-5,9-10H2,1-3H3