ethyl 3-(thiolan-3-ylamino)benzoate

Systemtic Name: ethyl 3-(thiolan-3-ylamino)benzoate Openeye Name: ethyl 3-(tetrahydrothiophen-3-ylamino)benzoate CAS Name: 3-(3-thiolanylamino)benzoic acid ethyl ester IUPAC Name: ethyl 3-(thiolan-3-ylamino)benzoate Traditional Name: 3-(tetrahydrothiophen-3-ylamino)benzoic acid ethyl ester Formula: C13H17NO2S MolecularWeight: 251.34458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC2CCSC2

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC2CCSC2

InChI

InChI=1S/C13H17NO2S/c1-2-16-13(15)10-4-3-5-11(8-10)14-12-6-7-17-9-12/h3-5,8,12,14H,2,6-7,9H2,1H3