methyl 2-azanyl-3-(thiolan-2-yl)benzoate

Systemtic Name: methyl 2-azanyl-3-(thiolan-2-yl)benzoate Openeye Name: methyl 2-amino-3-tetrahydrothiophen-2-yl-benzoate CAS Name: 2-amino-3-(2-thiolanyl)benzoic acid methyl ester IUPAC Name: methyl 2-amino-3-(thiolan-2-yl)benzoate Traditional Name: 2-amino-3-tetrahydrothiophen-2-yl-benzoic acid methyl ester Formula: C12H15NO2S MolecularWeight: 237.318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=CC=C1)C2CCCS2)N

Isomeric SMILES

COC(=O)C1=C(C(=CC=C1)C2CCCS2)N

InChI

InChI=1S/C12H15NO2S/c1-15-12(14)9-5-2-4-8(11(9)13)10-6-3-7-16-10/h2,4-5,10H,3,6-7,13H2,1H3