2-(1-morpholin-4-ylethylsulfanyl)benzoic acid

Systemtic Name: 2-(1-morpholin-4-ylethylsulfanyl)benzoic acid Openeye Name: 2-(1-morpholinoethylsulfanyl)benzoic acid CAS Name: 2-[1-(4-morpholinyl)ethylthio]benzoic acid IUPAC Name: 2-(1-morpholin-4-ylethylsulfanyl)benzoic acid Traditional Name: 2-(1-morpholinoethylthio)benzoic acid Formula: C13H17NO3S MolecularWeight: 267.34398

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Descriptors Computed from Structure

Canonical SMILES:

CC(N1CCOCC1)SC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC(N1CCOCC1)SC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C13H17NO3S/c1-10(14-6-8-17-9-7-14)18-12-5-3-2-4-11(12)13(15)16/h2-5,10H,6-9H2,1H3,(H,15,16)